1-(2-amino-7H-purin-6-yl)piperidine-3-carboxamide

C11H15N7O — CID 115669348

IUPAC1-(2-amino-7H-purin-6-yl)piperidine-3-carboxamide
SMILESNC(=O)C1CCCN(c2nc(N)nc3nc[nH]c23)C1
InChIInChI=1S/C11H15N7O/c12-8(19)6-2-1-3-18(4-6)10-7-9(15-5-14-7)16-11(13)17-10/h5-6H,1-4H2,(H2,12,19)(H3,13,14,15,16,17)
InChIKeyBUVIPKPLQKJDJQ-UHFFFAOYSA-N
MW261.29 g/mol
LogP-0.36
Rot. Bonds2

About 1-(2-amino-7H-purin-6-yl)piperidine-3-carboxamide

1-(2-amino-7H-purin-6-yl)piperidine-3-carboxamide (PubChem CID 115669348) has the molecular formula C11H15N7O and a molecular weight of 261.29 g/mol. Its IUPAC name is 1-(2-amino-7H-purin-6-yl)piperidine-3-carboxamide.

Molecular Properties

Compound Name1-(2-amino-7H-purin-6-yl)piperidine-3-carboxamide
PubChem CID115669348
Molecular FormulaC11H15N7O
Molecular Weight261.29 g/mol
Exact Mass261.13
IUPAC Name1-(2-amino-7H-purin-6-yl)piperidine-3-carboxamide
SMILESNC(=O)C1CCCN(c2nc(N)nc3nc[nH]c23)C1
InChIInChI=1S/C11H15N7O/c12-8(19)6-2-1-3-18(4-6)10-7-9(15-5-14-7)16-11(13)17-10/h5-6H,1-4H2,(H2,12,19)(H3,13,14,15,16,17)
InChIKeyBUVIPKPLQKJDJQ-UHFFFAOYSA-N
XLogP-0.36
TPSA126.81 Ų
H-Bond Donors3
H-Bond Acceptors6
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500261.29
LogP ≤ 5-0.36
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 106

Analyze 1-(2-amino-7H-purin-6-yl)piperidine-3-carboxamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

1-(2-amino-7H-purin-6-yl)-N-methylpiperidine-3-carboxamide
CID 103718742
1-(2-amino-7H-purin-6-yl)-3-methylpiperidin-4-ol
CID 114749498
6-(3-methoxypyrrolidin-1-yl)-7H-purin-2-amine
CID 103541736
6-(4-methylpiperidin-1-yl)-7H-purin-2-amine
CID 44776716
6-[3-(2-methylpiperidin-1-yl)azetidin-1-yl]-7H-purin-2-amine
CID 72902832
3-[(3R,4S)-1-(2-amino-7H-purin-6-yl)-4-morpholin-4-ylpiperidin-3-yl]propanoic acid
CID 72862681
6-(3,6-dihydro-2H-pyridin-1-yl)-7H-purin-2-amine
CID 104623927
4-(2-amino-7H-purin-6-yl)piperazine-2,6-dione
CID 114785546
1-[4-(2-amino-7H-purin-6-yl)piperazin-1-yl]-2-methylpropan-1-one
CID 166212074
6-(8-azaspiro[4.5]decan-8-yl)-7H-purin-2-amine
CID 104623737
(3R)-1-[2-(4-piperazin-1-ylanilino)-7H-purin-6-yl]piperidine-3-carboxylic acid
CID 71244213
N-[1-(2-amino-7H-purin-6-yl)piperidin-4-yl]methanesulfonamide
CID 72881722

Frequently Asked Questions

What is the IUPAC name of 1-(2-amino-7H-purin-6-yl)piperidine-3-carboxamide?
The IUPAC name of 1-(2-amino-7H-purin-6-yl)piperidine-3-carboxamide (CID 115669348) is 1-(2-amino-7H-purin-6-yl)piperidine-3-carboxamide.
What is the SMILES notation for 1-(2-amino-7H-purin-6-yl)piperidine-3-carboxamide?
The canonical SMILES for 1-(2-amino-7H-purin-6-yl)piperidine-3-carboxamide is NC(=O)C1CCCN(c2nc(N)nc3nc[nH]c23)C1.
What is the InChIKey of 1-(2-amino-7H-purin-6-yl)piperidine-3-carboxamide?
The InChIKey is BUVIPKPLQKJDJQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H15N7O/c12-8(19)6-2-1-3-18(4-6)10-7-9(15-5-14-7)16-11(13)17-10/h5-6H,1-4H2,(H2,12,19)(H3,13,14,15,16,17).
What are the key properties of 1-(2-amino-7H-purin-6-yl)piperidine-3-carboxamide?
1-(2-amino-7H-purin-6-yl)piperidine-3-carboxamide has a molecular weight of 261.29 g/mol, XLogP of -0.36, 2 rotatable bonds, 3 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-amino-7H-purin-6-yl)piperidine-3-carboxamide is sourced from PubChem (CID 115669348), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).