1-(3,5-diamino-2-pyridinyl)piperidine-4-carboxamide

C11H17N5O — CID 21082843

IUPAC1-(3,5-diamino-2-pyridinyl)piperidine-4-carboxamide
SMILESNC(=O)C1CCN(c2ncc(N)cc2N)CC1
InChIInChI=1S/C11H17N5O/c12-8-5-9(13)11(15-6-8)16-3-1-7(2-4-16)10(14)17/h5-7H,1-4,12-13H2,(H2,14,17)
InChIKeyFABXCQMSJQEPRG-UHFFFAOYSA-N
MW235.29 g/mol
LogP-0.05
Rot. Bonds2

About 1-(3,5-diamino-2-pyridinyl)piperidine-4-carboxamide

1-(3,5-diamino-2-pyridinyl)piperidine-4-carboxamide (PubChem CID 21082843) has the molecular formula C11H17N5O and a molecular weight of 235.29 g/mol. Its IUPAC name is 1-(3,5-diamino-2-pyridinyl)piperidine-4-carboxamide.

Molecular Properties

Compound Name1-(3,5-diamino-2-pyridinyl)piperidine-4-carboxamide
PubChem CID21082843
Molecular FormulaC11H17N5O
Molecular Weight235.29 g/mol
Exact Mass235.14
IUPAC Name1-(3,5-diamino-2-pyridinyl)piperidine-4-carboxamide
SMILESNC(=O)C1CCN(c2ncc(N)cc2N)CC1
InChIInChI=1S/C11H17N5O/c12-8-5-9(13)11(15-6-8)16-3-1-7(2-4-16)10(14)17/h5-7H,1-4,12-13H2,(H2,14,17)
InChIKeyFABXCQMSJQEPRG-UHFFFAOYSA-N
XLogP-0.05
TPSA111.26 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500235.29
LogP ≤ 5-0.05
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

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Related Compounds

1-(3-Nitropyridin-2-yl)piperidine-4-carboxamide
CID 2805612
1-(3-Cyanopyridin-2-yl)piperidine-4-carboxamide
CID 2813162
1-[5-(Trifluoromethyl)pyridin-2-yl]piperidine-4-carboxamide
CID 2821933
N-phenyl-2-(4-pyridin-2-ylpiperazin-1-yl)acetamide
CID 4780744
2-(Piperazin-1-yl)pyridin-3-amine
CID 10397358
6-((S)-3-Amino-4-oxo-4-piperidin-1-yl-butylamino)-nicotinonitrile
CID 11289193
n-Isobutyl-4-(4-methylpiperazin-1-yl)pyridin-2-amine
CID 44546966
N-(5-amino-4-(morpholinomethyl)pyridin-2-yl)-2,2-dimethylbutanamide
CID 45487760
Cyclobutyl-(4-pyridin-2-ylpiperazin-1-yl)methanone
CID 831602
2-Methyl-1-(4-(pyridin-2-yl)piperazin-1-yl)propan-1-one
CID 18340861
2-(4-Methylpiperazin-1-yl)pyridin-3-amine
CID 199808
1-Piperazinepropanamide, N-(4-aminophenyl)-4-(2-pyridinyl)-
CID 3070500

Frequently Asked Questions

What is the IUPAC name of 1-(3,5-diamino-2-pyridinyl)piperidine-4-carboxamide?
The IUPAC name of 1-(3,5-diamino-2-pyridinyl)piperidine-4-carboxamide (CID 21082843) is 1-(3,5-diamino-2-pyridinyl)piperidine-4-carboxamide.
What is the SMILES notation for 1-(3,5-diamino-2-pyridinyl)piperidine-4-carboxamide?
The canonical SMILES for 1-(3,5-diamino-2-pyridinyl)piperidine-4-carboxamide is NC(=O)C1CCN(c2ncc(N)cc2N)CC1.
What is the InChIKey of 1-(3,5-diamino-2-pyridinyl)piperidine-4-carboxamide?
The InChIKey is FABXCQMSJQEPRG-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H17N5O/c12-8-5-9(13)11(15-6-8)16-3-1-7(2-4-16)10(14)17/h5-7H,1-4,12-13H2,(H2,14,17).
What are the key properties of 1-(3,5-diamino-2-pyridinyl)piperidine-4-carboxamide?
1-(3,5-diamino-2-pyridinyl)piperidine-4-carboxamide has a molecular weight of 235.29 g/mol, XLogP of -0.05, 2 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(3,5-diamino-2-pyridinyl)piperidine-4-carboxamide is sourced from PubChem (CID 21082843), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).