N-(piperidin-2-ylmethyl)-1H-imidazo[4,5-b]pyridin-2-amine;hydrochloride

C12H18ClN5 — CID 71636800

IUPACN-(piperidin-2-ylmethyl)-1H-imidazo[4,5-b]pyridin-2-amine;hydrochloride
SMILESCl.c1cnc2nc(NCC3CCCCN3)[nH]c2c1
InChIInChI=1S/C12H17N5.ClH/c1-2-6-13-9(4-1)8-15-12-16-10-5-3-7-14-11(10)17-12;/h3,5,7,9,13H,1-2,4,6,8H2,(H2,14,15,16,17);1H
InChIKeyQQBLCFAOLWCIFP-UHFFFAOYSA-N
MW267.76 g/mol
LogP1.93
Rot. Bonds3

About N-(piperidin-2-ylmethyl)-1H-imidazo[4,5-b]pyridin-2-amine;hydrochloride

N-(piperidin-2-ylmethyl)-1H-imidazo[4,5-b]pyridin-2-amine;hydrochloride (PubChem CID 71636800) has the molecular formula C12H18ClN5 and a molecular weight of 267.76 g/mol. Its IUPAC name is N-(piperidin-2-ylmethyl)-1H-imidazo[4,5-b]pyridin-2-amine;hydrochloride.

Molecular Properties

Compound NameN-(piperidin-2-ylmethyl)-1H-imidazo[4,5-b]pyridin-2-amine;hydrochloride
PubChem CID71636800
Molecular FormulaC12H18ClN5
Molecular Weight267.76 g/mol
Exact Mass267.13
IUPAC NameN-(piperidin-2-ylmethyl)-1H-imidazo[4,5-b]pyridin-2-amine;hydrochloride
SMILESCl.c1cnc2nc(NCC3CCCCN3)[nH]c2c1
InChIInChI=1S/C12H17N5.ClH/c1-2-6-13-9(4-1)8-15-12-16-10-5-3-7-14-11(10)17-12;/h3,5,7,9,13H,1-2,4,6,8H2,(H2,14,15,16,17);1H
InChIKeyQQBLCFAOLWCIFP-UHFFFAOYSA-N
XLogP1.93
TPSA65.63 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500267.76
LogP ≤ 51.93
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Related Compounds

N-(piperidin-2-ylmethyl)-1H-benzimidazol-2-amine;hydrochloride
CID 71636788
2-(2-piperidin-2-ylethyl)-1H-imidazo[4,5-b]pyridine
CID 62217550
2-(2-piperidin-2-ylethoxy)-1H-imidazo[4,5-b]pyridine;hydrochloride
CID 71636567
N-piperidin-4-yl-1H-imidazo[4,5-b]pyridin-2-amine;hydrochloride
CID 71637244
molecular hydrogen;N-(piperidin-2-ylmethyl)-6-(2H-pyrazolo[3,4-b]pyridin-3-yl)pyridin-2-amine
CID 159524618
2,6-dichloro-N-(piperidin-2-ylmethyl)aniline
CID 106634051
N-[[(2S)-piperidin-2-yl]methyl]quinoxalin-2-amine
CID 94416055
2-(1-ethylpiperidin-2-yl)-1H-imidazo[4,5-b]pyridine
CID 117163031
5-bromo-N-(piperidin-2-ylmethyl)isoquinolin-1-amine
CID 106540424
3-(piperidin-2-ylmethylamino)pyridazine-4-carbonitrile
CID 80515109
3-methoxy-N-(pyrrolidin-2-ylmethyl)pyridin-2-amine
CID 83833834
N-(6,8-dibromo-1,2,3,4-tetrahydroquinolin-4-yl)-N'-(1H-imidazo[4,5-b]pyridin-2-yl)propane-1,3-diamine;hydrochloride
CID 10346465

Frequently Asked Questions

What is the IUPAC name of N-(piperidin-2-ylmethyl)-1H-imidazo[4,5-b]pyridin-2-amine;hydrochloride?
The IUPAC name of N-(piperidin-2-ylmethyl)-1H-imidazo[4,5-b]pyridin-2-amine;hydrochloride (CID 71636800) is N-(piperidin-2-ylmethyl)-1H-imidazo[4,5-b]pyridin-2-amine;hydrochloride.
What is the SMILES notation for N-(piperidin-2-ylmethyl)-1H-imidazo[4,5-b]pyridin-2-amine;hydrochloride?
The canonical SMILES for N-(piperidin-2-ylmethyl)-1H-imidazo[4,5-b]pyridin-2-amine;hydrochloride is Cl.c1cnc2nc(NCC3CCCCN3)[nH]c2c1.
What is the InChIKey of N-(piperidin-2-ylmethyl)-1H-imidazo[4,5-b]pyridin-2-amine;hydrochloride?
The InChIKey is QQBLCFAOLWCIFP-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H17N5.ClH/c1-2-6-13-9(4-1)8-15-12-16-10-5-3-7-14-11(10)17-12;/h3,5,7,9,13H,1-2,4,6,8H2,(H2,14,15,16,17);1H.
What are the key properties of N-(piperidin-2-ylmethyl)-1H-imidazo[4,5-b]pyridin-2-amine;hydrochloride?
N-(piperidin-2-ylmethyl)-1H-imidazo[4,5-b]pyridin-2-amine;hydrochloride has a molecular weight of 267.76 g/mol, XLogP of 1.93, 3 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(piperidin-2-ylmethyl)-1H-imidazo[4,5-b]pyridin-2-amine;hydrochloride is sourced from PubChem (CID 71636800), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).