[5-(dimethylamino)-3,4-dihydro-1H-2,6-naphthyridin-2-yl]-[(5R,7S)-2,5,7-trimethyl-5,7-dihydro-4H-pyrano[3,4-c]pyrazol-3-yl]methanone

C20H27N5O2 — CID 146093592

IUPAC[5-(dimethylamino)-3,4-dihydro-1H-2,6-naphthyridin-2-yl]-[(5R,7S)-2,5,7-trimethyl-5,7-dihydro-4H-pyrano[3,4-c]pyrazol-3-yl]methanone
SMILESC[C@@H]1Cc2c(nn(C)c2C(=O)N2CCc3c(ccnc3N(C)C)C2)[C@H](C)O1
InChIInChI=1S/C20H27N5O2/c1-12-10-16-17(13(2)27-12)22-24(5)18(16)20(26)25-9-7-15-14(11-25)6-8-21-19(15)23(3)4/h6,8,12-13H,7,9-11H2,1-5H3/t12-,13+/m1/s1
InChIKeyFSBBSMNWIXADSZ-OLZOCXBDSA-N
MW369.47 g/mol
LogP2.10
Rot. Bonds2

About [5-(dimethylamino)-3,4-dihydro-1H-2,6-naphthyridin-2-yl]-[(5R,7S)-2,5,7-trimethyl-5,7-dihydro-4H-pyrano[3,4-c]pyrazol-3-yl]methanone

[5-(dimethylamino)-3,4-dihydro-1H-2,6-naphthyridin-2-yl]-[(5R,7S)-2,5,7-trimethyl-5,7-dihydro-4H-pyrano[3,4-c]pyrazol-3-yl]methanone (PubChem CID 146093592) has the molecular formula C20H27N5O2 and a molecular weight of 369.47 g/mol. Its IUPAC name is [5-(dimethylamino)-3,4-dihydro-1H-2,6-naphthyridin-2-yl]-[(5R,7S)-2,5,7-trimethyl-5,7-dihydro-4H-pyrano[3,4-c]pyrazol-3-yl]methanone.

Molecular Properties

Compound Name[5-(dimethylamino)-3,4-dihydro-1H-2,6-naphthyridin-2-yl]-[(5R,7S)-2,5,7-trimethyl-5,7-dihydro-4H-pyrano[3,4-c]pyrazol-3-yl]methanone
PubChem CID146093592
Molecular FormulaC20H27N5O2
Molecular Weight369.47 g/mol
Exact Mass369.22
IUPAC Name[5-(dimethylamino)-3,4-dihydro-1H-2,6-naphthyridin-2-yl]-[(5R,7S)-2,5,7-trimethyl-5,7-dihydro-4H-pyrano[3,4-c]pyrazol-3-yl]methanone
SMILESC[C@@H]1Cc2c(nn(C)c2C(=O)N2CCc3c(ccnc3N(C)C)C2)[C@H](C)O1
InChIInChI=1S/C20H27N5O2/c1-12-10-16-17(13(2)27-12)22-24(5)18(16)20(26)25-9-7-15-14(11-25)6-8-21-19(15)23(3)4/h6,8,12-13H,7,9-11H2,1-5H3/t12-,13+/m1/s1
InChIKeyFSBBSMNWIXADSZ-OLZOCXBDSA-N
XLogP2.10
TPSA63.49 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds2
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500369.47
LogP ≤ 52.10
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

Analyze [5-(dimethylamino)-3,4-dihydro-1H-2,6-naphthyridin-2-yl]-[(5R,7S)-2,5,7-trimethyl-5,7-dihydro-4H-pyrano[3,4-c]pyrazol-3-yl]methanone with MolForge

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Frequently Asked Questions

What is the IUPAC name of [5-(dimethylamino)-3,4-dihydro-1H-2,6-naphthyridin-2-yl]-[(5R,7S)-2,5,7-trimethyl-5,7-dihydro-4H-pyrano[3,4-c]pyrazol-3-yl]methanone?
The IUPAC name of [5-(dimethylamino)-3,4-dihydro-1H-2,6-naphthyridin-2-yl]-[(5R,7S)-2,5,7-trimethyl-5,7-dihydro-4H-pyrano[3,4-c]pyrazol-3-yl]methanone (CID 146093592) is [5-(dimethylamino)-3,4-dihydro-1H-2,6-naphthyridin-2-yl]-[(5R,7S)-2,5,7-trimethyl-5,7-dihydro-4H-pyrano[3,4-c]pyrazol-3-yl]methanone.
What is the SMILES notation for [5-(dimethylamino)-3,4-dihydro-1H-2,6-naphthyridin-2-yl]-[(5R,7S)-2,5,7-trimethyl-5,7-dihydro-4H-pyrano[3,4-c]pyrazol-3-yl]methanone?
The canonical SMILES for [5-(dimethylamino)-3,4-dihydro-1H-2,6-naphthyridin-2-yl]-[(5R,7S)-2,5,7-trimethyl-5,7-dihydro-4H-pyrano[3,4-c]pyrazol-3-yl]methanone is C[C@@H]1Cc2c(nn(C)c2C(=O)N2CCc3c(ccnc3N(C)C)C2)[C@H](C)O1.
What is the InChIKey of [5-(dimethylamino)-3,4-dihydro-1H-2,6-naphthyridin-2-yl]-[(5R,7S)-2,5,7-trimethyl-5,7-dihydro-4H-pyrano[3,4-c]pyrazol-3-yl]methanone?
The InChIKey is FSBBSMNWIXADSZ-OLZOCXBDSA-N. The full InChI is InChI=1S/C20H27N5O2/c1-12-10-16-17(13(2)27-12)22-24(5)18(16)20(26)25-9-7-15-14(11-25)6-8-21-19(15)23(3)4/h6,8,12-13H,7,9-11H2,1-5H3/t12-,13+/m1/s1.
What are the key properties of [5-(dimethylamino)-3,4-dihydro-1H-2,6-naphthyridin-2-yl]-[(5R,7S)-2,5,7-trimethyl-5,7-dihydro-4H-pyrano[3,4-c]pyrazol-3-yl]methanone?
[5-(dimethylamino)-3,4-dihydro-1H-2,6-naphthyridin-2-yl]-[(5R,7S)-2,5,7-trimethyl-5,7-dihydro-4H-pyrano[3,4-c]pyrazol-3-yl]methanone has a molecular weight of 369.47 g/mol, XLogP of 2.10, 2 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for [5-(dimethylamino)-3,4-dihydro-1H-2,6-naphthyridin-2-yl]-[(5R,7S)-2,5,7-trimethyl-5,7-dihydro-4H-pyrano[3,4-c]pyrazol-3-yl]methanone is sourced from PubChem (CID 146093592), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).