7-[[(3S)-piperidin-3-yl]amino]-2,6-naphthyridine-3-carbonitrile

C14H15N5 — CID 168932124

IUPAC7-[[(3S)-piperidin-3-yl]amino]-2,6-naphthyridine-3-carbonitrile
SMILESN#Cc1cc2cnc(N[C@H]3CCCNC3)cc2cn1
InChIInChI=1S/C14H15N5/c15-6-13-4-10-8-18-14(5-11(10)7-17-13)19-12-2-1-3-16-9-12/h4-5,7-8,12,16H,1-3,9H2,(H,18,19)/t12-/m0/s1
InChIKeyWJRTYMJWOQVKET-LBPRGKRZSA-N
MW253.31 g/mol
LogP1.67
Rot. Bonds2

About 7-[[(3S)-piperidin-3-yl]amino]-2,6-naphthyridine-3-carbonitrile

7-[[(3S)-piperidin-3-yl]amino]-2,6-naphthyridine-3-carbonitrile (PubChem CID 168932124) has the molecular formula C14H15N5 and a molecular weight of 253.31 g/mol. Its IUPAC name is 7-[[(3S)-piperidin-3-yl]amino]-2,6-naphthyridine-3-carbonitrile.

Molecular Properties

Compound Name7-[[(3S)-piperidin-3-yl]amino]-2,6-naphthyridine-3-carbonitrile
PubChem CID168932124
Molecular FormulaC14H15N5
Molecular Weight253.31 g/mol
Exact Mass253.13
IUPAC Name7-[[(3S)-piperidin-3-yl]amino]-2,6-naphthyridine-3-carbonitrile
SMILESN#Cc1cc2cnc(N[C@H]3CCCNC3)cc2cn1
InChIInChI=1S/C14H15N5/c15-6-13-4-10-8-18-14(5-11(10)7-17-13)19-12-2-1-3-16-9-12/h4-5,7-8,12,16H,1-3,9H2,(H,18,19)/t12-/m0/s1
InChIKeyWJRTYMJWOQVKET-LBPRGKRZSA-N
XLogP1.67
TPSA73.63 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500253.31
LogP ≤ 51.67
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

1-cyclopentyloxy-7-[[(3S)-piperidin-3-yl]amino]-2,6-naphthyridine-3-carbonitrile
CID 168932275
1-(diethylamino)-7-[[(3S)-piperidin-3-yl]amino]-2,6-naphthyridine-3-carbonitrile
CID 168932072
1-[(1-methylcyclopropyl)amino]-7-[[(3S)-piperidin-3-yl]amino]-2,6-naphthyridine-3-carbonitrile
CID 168932347
5-(piperidin-3-ylamino)pyridine-2-carbonitrile
CID 115490388
2-[[(3R)-piperidin-3-yl]amino]-8-(propan-2-ylamino)pyrido[3,4-d]pyrimidine-6-carbonitrile
CID 168932145
6-N-cyclobutyl-2-methyl-4-N-piperidin-3-ylpyrimidine-4,6-diamine
CID 115266503
2-(pyrrolidin-3-ylamino)pyridine-4-carbonitrile;hydrochloride
CID 71643662
3-(difluoromethyl)-7-N-[(3S)-piperidin-3-yl]-2,6-naphthyridine-1,7-diamine
CID 170188347
N-pyrrolidin-3-yl-6,7-dihydro-5H-cyclopenta[c]pyridin-3-amine
CID 112709889
4-methyl-N-[(3R)-piperidin-3-yl]pyridin-2-amine;hydrochloride
CID 71638526
6-pentan-3-yl-N-piperidin-3-ylpyrimidin-4-amine
CID 126848416
5-[[4-(pyrrolidin-3-ylamino)-6-(trifluoromethyl)pyrimidin-2-yl]amino]pyridine-2-carbonitrile
CID 151835597

Frequently Asked Questions

What is the IUPAC name of 7-[[(3S)-piperidin-3-yl]amino]-2,6-naphthyridine-3-carbonitrile?
The IUPAC name of 7-[[(3S)-piperidin-3-yl]amino]-2,6-naphthyridine-3-carbonitrile (CID 168932124) is 7-[[(3S)-piperidin-3-yl]amino]-2,6-naphthyridine-3-carbonitrile.
What is the SMILES notation for 7-[[(3S)-piperidin-3-yl]amino]-2,6-naphthyridine-3-carbonitrile?
The canonical SMILES for 7-[[(3S)-piperidin-3-yl]amino]-2,6-naphthyridine-3-carbonitrile is N#Cc1cc2cnc(N[C@H]3CCCNC3)cc2cn1.
What is the InChIKey of 7-[[(3S)-piperidin-3-yl]amino]-2,6-naphthyridine-3-carbonitrile?
The InChIKey is WJRTYMJWOQVKET-LBPRGKRZSA-N. The full InChI is InChI=1S/C14H15N5/c15-6-13-4-10-8-18-14(5-11(10)7-17-13)19-12-2-1-3-16-9-12/h4-5,7-8,12,16H,1-3,9H2,(H,18,19)/t12-/m0/s1.
What are the key properties of 7-[[(3S)-piperidin-3-yl]amino]-2,6-naphthyridine-3-carbonitrile?
7-[[(3S)-piperidin-3-yl]amino]-2,6-naphthyridine-3-carbonitrile has a molecular weight of 253.31 g/mol, XLogP of 1.67, 2 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 7-[[(3S)-piperidin-3-yl]amino]-2,6-naphthyridine-3-carbonitrile is sourced from PubChem (CID 168932124), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).