5-amino-N-[1-(2-amino-2-oxoethyl)piperidin-4-yl]-2-methylpyridine-3-carboxamide

C14H21N5O2 — CID 61139255

IUPAC5-amino-N-[1-(2-amino-2-oxoethyl)piperidin-4-yl]-2-methylpyridine-3-carboxamide
SMILESCc1ncc(N)cc1C(=O)NC1CCN(CC(N)=O)CC1
InChIInChI=1S/C14H21N5O2/c1-9-12(6-10(15)7-17-9)14(21)18-11-2-4-19(5-3-11)8-13(16)20/h6-7,11H,2-5,8,15H2,1H3,(H2,16,20)(H,18,21)
InChIKeyVLQTXWRXOFAYJZ-UHFFFAOYSA-N
MW291.35 g/mol
LogP-0.35
Rot. Bonds4

About 5-amino-N-[1-(2-amino-2-oxoethyl)piperidin-4-yl]-2-methylpyridine-3-carboxamide

5-amino-N-[1-(2-amino-2-oxoethyl)piperidin-4-yl]-2-methylpyridine-3-carboxamide (PubChem CID 61139255) has the molecular formula C14H21N5O2 and a molecular weight of 291.35 g/mol. Its IUPAC name is 5-amino-N-[1-(2-amino-2-oxoethyl)piperidin-4-yl]-2-methylpyridine-3-carboxamide.

Molecular Properties

Compound Name5-amino-N-[1-(2-amino-2-oxoethyl)piperidin-4-yl]-2-methylpyridine-3-carboxamide
PubChem CID61139255
Molecular FormulaC14H21N5O2
Molecular Weight291.35 g/mol
Exact Mass291.17
IUPAC Name5-amino-N-[1-(2-amino-2-oxoethyl)piperidin-4-yl]-2-methylpyridine-3-carboxamide
SMILESCc1ncc(N)cc1C(=O)NC1CCN(CC(N)=O)CC1
InChIInChI=1S/C14H21N5O2/c1-9-12(6-10(15)7-17-9)14(21)18-11-2-4-19(5-3-11)8-13(16)20/h6-7,11H,2-5,8,15H2,1H3,(H2,16,20)(H,18,21)
InChIKeyVLQTXWRXOFAYJZ-UHFFFAOYSA-N
XLogP-0.35
TPSA114.34 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500291.35
LogP ≤ 5-0.35
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

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Related Compounds

5-amino-2-methyl-N-(1-methylpiperidin-4-yl)pyridine-3-carboxamide
CID 54917300
5-amino-N-cyclohexyl-2-methylpyridine-3-carboxamide
CID 61039080
N-[1-(2-amino-2-oxoethyl)piperidin-4-yl]-5-methyl-1H-pyrazole-4-carboxamide
CID 63999078
5-amino-N-(1,1-dioxothiolan-3-yl)-2-methylpyridine-3-carboxamide
CID 54917004
3-amino-N-[1-(2-amino-2-oxoethyl)piperidin-4-yl]-2-methylbenzamide
CID 61140963
3-amino-N-[1-(2-amino-2-oxoethyl)piperidin-4-yl]benzamide
CID 43711659
N-[1-(2-amino-2-oxoethyl)piperidin-4-yl]-2-fluoro-3-methylbenzamide
CID 80710716
5-amino-N-[2-(azepan-1-yl)ethyl]-2-methylpyridine-3-carboxamide
CID 61241531
2-amino-N-[1-(2-amino-2-oxoethyl)piperidin-4-yl]-5-chlorobenzamide
CID 61140773
5-amino-N-(1,3-dimethylpiperidin-4-yl)-2-methylpyridine-3-carboxamide
CID 114502792
N-[1-(2-amino-2-oxoethyl)piperidin-4-yl]-5-bromopyridine-3-carboxamide
CID 53498700
5-amino-N-(4-amino-2-methyl-4-oxobutan-2-yl)-2-methylpyridine-3-carboxamide
CID 106095327

Frequently Asked Questions

What is the IUPAC name of 5-amino-N-[1-(2-amino-2-oxoethyl)piperidin-4-yl]-2-methylpyridine-3-carboxamide?
The IUPAC name of 5-amino-N-[1-(2-amino-2-oxoethyl)piperidin-4-yl]-2-methylpyridine-3-carboxamide (CID 61139255) is 5-amino-N-[1-(2-amino-2-oxoethyl)piperidin-4-yl]-2-methylpyridine-3-carboxamide.
What is the SMILES notation for 5-amino-N-[1-(2-amino-2-oxoethyl)piperidin-4-yl]-2-methylpyridine-3-carboxamide?
The canonical SMILES for 5-amino-N-[1-(2-amino-2-oxoethyl)piperidin-4-yl]-2-methylpyridine-3-carboxamide is Cc1ncc(N)cc1C(=O)NC1CCN(CC(N)=O)CC1.
What is the InChIKey of 5-amino-N-[1-(2-amino-2-oxoethyl)piperidin-4-yl]-2-methylpyridine-3-carboxamide?
The InChIKey is VLQTXWRXOFAYJZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H21N5O2/c1-9-12(6-10(15)7-17-9)14(21)18-11-2-4-19(5-3-11)8-13(16)20/h6-7,11H,2-5,8,15H2,1H3,(H2,16,20)(H,18,21).
What are the key properties of 5-amino-N-[1-(2-amino-2-oxoethyl)piperidin-4-yl]-2-methylpyridine-3-carboxamide?
5-amino-N-[1-(2-amino-2-oxoethyl)piperidin-4-yl]-2-methylpyridine-3-carboxamide has a molecular weight of 291.35 g/mol, XLogP of -0.35, 4 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-amino-N-[1-(2-amino-2-oxoethyl)piperidin-4-yl]-2-methylpyridine-3-carboxamide is sourced from PubChem (CID 61139255), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).