7-(3-methoxy-4-morpholin-4-ylphenyl)-N-(pyrrolidin-3-ylmethyl)-1,6-naphthyridin-5-amine

C24H29N5O2 — CID 76775958

IUPAC7-(3-methoxy-4-morpholin-4-ylphenyl)-N-(pyrrolidin-3-ylmethyl)-1,6-naphthyridin-5-amine
SMILESCOc1cc(-c2cc3ncccc3c(NCC3CCNC3)n2)ccc1N1CCOCC1
InChIInChI=1S/C24H29N5O2/c1-30-23-13-18(4-5-22(23)29-9-11-31-12-10-29)20-14-21-19(3-2-7-26-21)24(28-20)27-16-17-6-8-25-15-17/h2-5,7,13-14,17,25H,6,8-12,15-16H2,1H3,(H,27,28)
InChIKeyVHIODPSKKPLFGP-UHFFFAOYSA-N
MW419.53 g/mol
LogP3.16
Rot. Bonds6

About 7-(3-methoxy-4-morpholin-4-ylphenyl)-N-(pyrrolidin-3-ylmethyl)-1,6-naphthyridin-5-amine

7-(3-methoxy-4-morpholin-4-ylphenyl)-N-(pyrrolidin-3-ylmethyl)-1,6-naphthyridin-5-amine (PubChem CID 76775958) has the molecular formula C24H29N5O2 and a molecular weight of 419.53 g/mol. Its IUPAC name is 7-(3-methoxy-4-morpholin-4-ylphenyl)-N-(pyrrolidin-3-ylmethyl)-1,6-naphthyridin-5-amine.

Molecular Properties

Compound Name7-(3-methoxy-4-morpholin-4-ylphenyl)-N-(pyrrolidin-3-ylmethyl)-1,6-naphthyridin-5-amine
PubChem CID76775958
Molecular FormulaC24H29N5O2
Molecular Weight419.53 g/mol
Exact Mass419.23
IUPAC Name7-(3-methoxy-4-morpholin-4-ylphenyl)-N-(pyrrolidin-3-ylmethyl)-1,6-naphthyridin-5-amine
SMILESCOc1cc(-c2cc3ncccc3c(NCC3CCNC3)n2)ccc1N1CCOCC1
InChIInChI=1S/C24H29N5O2/c1-30-23-13-18(4-5-22(23)29-9-11-31-12-10-29)20-14-21-19(3-2-7-26-21)24(28-20)27-16-17-6-8-25-15-17/h2-5,7,13-14,17,25H,6,8-12,15-16H2,1H3,(H,27,28)
InChIKeyVHIODPSKKPLFGP-UHFFFAOYSA-N
XLogP3.16
TPSA71.54 Ų
H-Bond Donors2
H-Bond Acceptors7
Rotatable Bonds6
Heavy Atoms31
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500419.53
LogP ≤ 53.16
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 107

Analyze 7-(3-methoxy-4-morpholin-4-ylphenyl)-N-(pyrrolidin-3-ylmethyl)-1,6-naphthyridin-5-amine with MolForge

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Related Compounds

Lexibulin
CID 11351021
Bos172722
CID 73386890
N8-[(2S)-3,3-dimethylbutan-2-yl]-N2-[2-methoxy-4-(1-methyl-1H-pyrazol-4-yl)phenyl]pyrido[3,4-d]pyrimidine-2,8-diamine
CID 73386882
N2-(2-Methoxy-4-(1-Methyl-1h-Pyrazol-4-Yl)phenyl)-N8-Neopentylpyrido[3,4-D]pyrimidine-2,8-Diamine
CID 73387064
3-(3,5-dimethoxyphenyl)-7-N-[3-(4-methylpiperazin-1-yl)propyl]-1,6-naphthyridine-2,7-diamine
CID 5330125
3-Tert-butyl-1-[3-(3,5-dimethoxyphenyl)-7-{[3-(morpholin-4-yl)propyl]amino}-1,6-naphthyridin-2-yl]urea
CID 5329004
1,6-Naphthyridine 24
CID 5330134
Vuf5574
CID 4046493
7-N-[4-(diethylamino)butyl]-3-(3,5-dimethoxyphenyl)-1,6-naphthyridine-2,7-diamine
CID 5330131
N(2)-[3-methoxy-4-(morpholin-4-yl)phenyl]-N(4)-(quinolin-3-yl)pyrimidine-2,4-diamine
CID 10202829
Dibenzo[c,f][2,7]naphthyridine, 14
CID 23648180
Dibenzo[c,f][2,7]naphthyridine, 16
CID 23648181

Frequently Asked Questions

What is the IUPAC name of 7-(3-methoxy-4-morpholin-4-ylphenyl)-N-(pyrrolidin-3-ylmethyl)-1,6-naphthyridin-5-amine?
The IUPAC name of 7-(3-methoxy-4-morpholin-4-ylphenyl)-N-(pyrrolidin-3-ylmethyl)-1,6-naphthyridin-5-amine (CID 76775958) is 7-(3-methoxy-4-morpholin-4-ylphenyl)-N-(pyrrolidin-3-ylmethyl)-1,6-naphthyridin-5-amine.
What is the SMILES notation for 7-(3-methoxy-4-morpholin-4-ylphenyl)-N-(pyrrolidin-3-ylmethyl)-1,6-naphthyridin-5-amine?
The canonical SMILES for 7-(3-methoxy-4-morpholin-4-ylphenyl)-N-(pyrrolidin-3-ylmethyl)-1,6-naphthyridin-5-amine is COc1cc(-c2cc3ncccc3c(NCC3CCNC3)n2)ccc1N1CCOCC1.
What is the InChIKey of 7-(3-methoxy-4-morpholin-4-ylphenyl)-N-(pyrrolidin-3-ylmethyl)-1,6-naphthyridin-5-amine?
The InChIKey is VHIODPSKKPLFGP-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H29N5O2/c1-30-23-13-18(4-5-22(23)29-9-11-31-12-10-29)20-14-21-19(3-2-7-26-21)24(28-20)27-16-17-6-8-25-15-17/h2-5,7,13-14,17,25H,6,8-12,15-16H2,1H3,(H,27,28).
What are the key properties of 7-(3-methoxy-4-morpholin-4-ylphenyl)-N-(pyrrolidin-3-ylmethyl)-1,6-naphthyridin-5-amine?
7-(3-methoxy-4-morpholin-4-ylphenyl)-N-(pyrrolidin-3-ylmethyl)-1,6-naphthyridin-5-amine has a molecular weight of 419.53 g/mol, XLogP of 3.16, 6 rotatable bonds, 2 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 7-(3-methoxy-4-morpholin-4-ylphenyl)-N-(pyrrolidin-3-ylmethyl)-1,6-naphthyridin-5-amine is sourced from PubChem (CID 76775958), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).