ethyl N-[6-[5-chloro-4-(3,5-dimethyl-2-pyridinyl)-2-pyridinyl]-7,8-dihydro-5H-1,6-naphthyridin-2-yl]carbamate

C23H24ClN5O2 — CID 77107010

IUPACethyl N-[6-[5-chloro-4-(3,5-dimethyl-2-pyridinyl)-2-pyridinyl]-7,8-dihydro-5H-1,6-naphthyridin-2-yl]carbamate
SMILESCCOC(=O)Nc1ccc2c(n1)CCN(c1cc(-c3ncc(C)cc3C)c(Cl)cn1)C2
InChIInChI=1S/C23H24ClN5O2/c1-4-31-23(30)28-20-6-5-16-13-29(8-7-19(16)27-20)21-10-17(18(24)12-25-21)22-15(3)9-14(2)11-26-22/h5-6,9-12H,4,7-8,13H2,1-3H3,(H,27,28,30)
InChIKeyPOXGMQNZFHQONK-UHFFFAOYSA-N
MW437.93 g/mol
LogP4.94
Rot. Bonds4

About ethyl N-[6-[5-chloro-4-(3,5-dimethyl-2-pyridinyl)-2-pyridinyl]-7,8-dihydro-5H-1,6-naphthyridin-2-yl]carbamate

ethyl N-[6-[5-chloro-4-(3,5-dimethyl-2-pyridinyl)-2-pyridinyl]-7,8-dihydro-5H-1,6-naphthyridin-2-yl]carbamate (PubChem CID 77107010) has the molecular formula C23H24ClN5O2 and a molecular weight of 437.93 g/mol. Its IUPAC name is ethyl N-[6-[5-chloro-4-(3,5-dimethyl-2-pyridinyl)-2-pyridinyl]-7,8-dihydro-5H-1,6-naphthyridin-2-yl]carbamate.

Molecular Properties

Compound Nameethyl N-[6-[5-chloro-4-(3,5-dimethyl-2-pyridinyl)-2-pyridinyl]-7,8-dihydro-5H-1,6-naphthyridin-2-yl]carbamate
PubChem CID77107010
Molecular FormulaC23H24ClN5O2
Molecular Weight437.93 g/mol
Exact Mass437.16
IUPAC Nameethyl N-[6-[5-chloro-4-(3,5-dimethyl-2-pyridinyl)-2-pyridinyl]-7,8-dihydro-5H-1,6-naphthyridin-2-yl]carbamate
SMILESCCOC(=O)Nc1ccc2c(n1)CCN(c1cc(-c3ncc(C)cc3C)c(Cl)cn1)C2
InChIInChI=1S/C23H24ClN5O2/c1-4-31-23(30)28-20-6-5-16-13-29(8-7-19(16)27-20)21-10-17(18(24)12-25-21)22-15(3)9-14(2)11-26-22/h5-6,9-12H,4,7-8,13H2,1-3H3,(H,27,28,30)
InChIKeyPOXGMQNZFHQONK-UHFFFAOYSA-N
XLogP4.94
TPSA80.24 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms31
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500437.93
LogP ≤ 54.94
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Analyze ethyl N-[6-[5-chloro-4-(3,5-dimethyl-2-pyridinyl)-2-pyridinyl]-7,8-dihydro-5H-1,6-naphthyridin-2-yl]carbamate with MolForge

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Related Compounds

6-[5-chloro-4-(3,5-dimethyl-2-pyridinyl)-2-pyridinyl]-2-piperazin-1-yl-7,8-dihydro-5H-1,6-naphthyridine
CID 77106811
1-[6-[5-chloro-4-(3,5-dimethyl-2-pyridinyl)-2-pyridinyl]-7,8-dihydro-5H-1,6-naphthyridin-2-yl]-N-methylpyrrolidin-3-amine
CID 77106422
5-[5-chloro-4-(3,5-dimethyl-2-pyridinyl)-2-pyridinyl]-2-ethoxy-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridine
CID 90299609
5-[5-chloro-4-(3,5-dimethyl-2-pyridinyl)-2-pyridinyl]-6,7-dihydro-4H-[1,2,5]thiadiazolo[3,4-c]pyridine
CID 78321675
1-[6-[5-chloro-4-(3,5-dimethyl-2-pyridinyl)-2-pyridinyl]-7,8-dihydro-5H-pyrido[4,3-d]pyrimidin-2-yl]pyrrolidin-3-amine
CID 77105411
1-[6-[5-chloro-4-(3,5-dimethyl-2-pyridinyl)-2-pyridinyl]-7,8-dihydro-5H-pyrido[4,3-d]pyrimidin-2-yl]-N-methylpyrrolidin-3-amine
CID 77105412
(3E)-1-[5-chloro-4-(3,5-dimethyl-2-pyridinyl)-2-pyridinyl]-3-hydrazinylidenepiperidin-4-one
CID 123136538
5-[5-chloro-4-(3,5-dimethyl-2-pyridinyl)-2-pyridinyl]-2-ethoxy-6,7-dihydro-[1,3]thiazolo[5,4-c]pyridin-4-one
CID 73438458
N-[5-[5-chloro-4-(3,5-dimethyl-2-pyridinyl)-2-pyridinyl]-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridin-2-yl]-3-morpholin-4-ylpropanamide
CID 118684796
1-[5-chloro-4-(3,5-dimethyl-2-pyridinyl)-2-pyridinyl]-4-methylpiperazine
CID 134426894
6-[5-chloro-4-(3,5-dimethyl-2-pyridinyl)-2-pyridinyl]-N-cyclopropyl-7,8-dihydro-5H-pyrido[4,3-d]pyrimidin-2-amine;N-cyclopropyl-5,6,7,8-tetrahydropyrido[4,3-d]pyrimidin-2-amine;2,5-dichloro-4-(3,5-dimethyl-2-pyridinyl)pyridine
CID 159780229
1-[4-[5-chloro-4-(3,5-dimethyl-2-pyridinyl)-2-pyridinyl]piperazin-1-yl]-2-hydroxyethanone
CID 67508530

Frequently Asked Questions

What is the IUPAC name of ethyl N-[6-[5-chloro-4-(3,5-dimethyl-2-pyridinyl)-2-pyridinyl]-7,8-dihydro-5H-1,6-naphthyridin-2-yl]carbamate?
The IUPAC name of ethyl N-[6-[5-chloro-4-(3,5-dimethyl-2-pyridinyl)-2-pyridinyl]-7,8-dihydro-5H-1,6-naphthyridin-2-yl]carbamate (CID 77107010) is ethyl N-[6-[5-chloro-4-(3,5-dimethyl-2-pyridinyl)-2-pyridinyl]-7,8-dihydro-5H-1,6-naphthyridin-2-yl]carbamate.
What is the SMILES notation for ethyl N-[6-[5-chloro-4-(3,5-dimethyl-2-pyridinyl)-2-pyridinyl]-7,8-dihydro-5H-1,6-naphthyridin-2-yl]carbamate?
The canonical SMILES for ethyl N-[6-[5-chloro-4-(3,5-dimethyl-2-pyridinyl)-2-pyridinyl]-7,8-dihydro-5H-1,6-naphthyridin-2-yl]carbamate is CCOC(=O)Nc1ccc2c(n1)CCN(c1cc(-c3ncc(C)cc3C)c(Cl)cn1)C2.
What is the InChIKey of ethyl N-[6-[5-chloro-4-(3,5-dimethyl-2-pyridinyl)-2-pyridinyl]-7,8-dihydro-5H-1,6-naphthyridin-2-yl]carbamate?
The InChIKey is POXGMQNZFHQONK-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H24ClN5O2/c1-4-31-23(30)28-20-6-5-16-13-29(8-7-19(16)27-20)21-10-17(18(24)12-25-21)22-15(3)9-14(2)11-26-22/h5-6,9-12H,4,7-8,13H2,1-3H3,(H,27,28,30).
What are the key properties of ethyl N-[6-[5-chloro-4-(3,5-dimethyl-2-pyridinyl)-2-pyridinyl]-7,8-dihydro-5H-1,6-naphthyridin-2-yl]carbamate?
ethyl N-[6-[5-chloro-4-(3,5-dimethyl-2-pyridinyl)-2-pyridinyl]-7,8-dihydro-5H-1,6-naphthyridin-2-yl]carbamate has a molecular weight of 437.93 g/mol, XLogP of 4.94, 4 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for ethyl N-[6-[5-chloro-4-(3,5-dimethyl-2-pyridinyl)-2-pyridinyl]-7,8-dihydro-5H-1,6-naphthyridin-2-yl]carbamate is sourced from PubChem (CID 77107010), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).