4-(3-aminopyrrolidin-1-yl)-N-methylpyridine-2-carboxamide

C11H16N4O — CID 62067734

IUPAC4-(3-aminopyrrolidin-1-yl)-N-methylpyridine-2-carboxamide
SMILESCNC(=O)c1cc(N2CCC(N)C2)ccn1
InChIInChI=1S/C11H16N4O/c1-13-11(16)10-6-9(2-4-14-10)15-5-3-8(12)7-15/h2,4,6,8H,3,5,7,12H2,1H3,(H,13,16)
InChIKeyNGRSOFSXWWPYRU-UHFFFAOYSA-N
MW220.28 g/mol
LogP-0.02
Rot. Bonds2

About 4-(3-aminopyrrolidin-1-yl)-N-methylpyridine-2-carboxamide

4-(3-aminopyrrolidin-1-yl)-N-methylpyridine-2-carboxamide (PubChem CID 62067734) has the molecular formula C11H16N4O and a molecular weight of 220.28 g/mol. Its IUPAC name is 4-(3-aminopyrrolidin-1-yl)-N-methylpyridine-2-carboxamide.

Molecular Properties

Compound Name4-(3-aminopyrrolidin-1-yl)-N-methylpyridine-2-carboxamide
PubChem CID62067734
Molecular FormulaC11H16N4O
Molecular Weight220.28 g/mol
Exact Mass220.13
IUPAC Name4-(3-aminopyrrolidin-1-yl)-N-methylpyridine-2-carboxamide
SMILESCNC(=O)c1cc(N2CCC(N)C2)ccn1
InChIInChI=1S/C11H16N4O/c1-13-11(16)10-6-9(2-4-14-10)15-5-3-8(12)7-15/h2,4,6,8H,3,5,7,12H2,1H3,(H,13,16)
InChIKeyNGRSOFSXWWPYRU-UHFFFAOYSA-N
XLogP-0.02
TPSA71.25 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500220.28
LogP ≤ 5-0.02
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

methyl 4-[2-(methylcarbamoyl)-4-pyridinyl]morpholine-2-carboxylate
CID 115538541
N-methyl-4-[3-(propylaminomethyl)piperidin-1-yl]pyridine-2-carboxamide
CID 63853891
4-[3-(methylcarbamoyl)pyrrolidin-1-yl]pyridine-2-carboxamide
CID 171704184
4-(4-amino-3-methylpiperidin-1-yl)-N-ethylpyridine-2-carboxamide
CID 79868126
1-[2-(methylcarbamoyl)-4-pyridinyl]pyrrolidine-2-carboxylic acid
CID 43517695
N-methyl-4-[3-(4-methyl-1,2,4-triazol-3-yl)piperidin-1-yl]pyridine-2-carboxamide
CID 136568235
4-(4-hydroxyiminopiperidin-1-yl)-N-methylpyridine-2-carboxamide
CID 43517734
3-methyl-1-[2-(methylcarbamoyl)-4-pyridinyl]pyrrolidine-2-carboxylic acid
CID 102776437
1-(2-cyclopropyl-4-pyridinyl)pyrrolidin-3-amine
CID 83832269
1-[2-(ethylcarbamoyl)-4-pyridinyl]pyrrolidine-3-carboxylic acid
CID 63032016
4-[(3R)-3-aminopyrrolidin-1-yl]-N-(2-methoxyethyl)pyridin-2-amine
CID 58227177
N-ethyl-4-[4-[1-(methylamino)ethyl]piperidin-1-yl]pyridine-2-carboxamide
CID 63853012

Frequently Asked Questions

What is the IUPAC name of 4-(3-aminopyrrolidin-1-yl)-N-methylpyridine-2-carboxamide?
The IUPAC name of 4-(3-aminopyrrolidin-1-yl)-N-methylpyridine-2-carboxamide (CID 62067734) is 4-(3-aminopyrrolidin-1-yl)-N-methylpyridine-2-carboxamide.
What is the SMILES notation for 4-(3-aminopyrrolidin-1-yl)-N-methylpyridine-2-carboxamide?
The canonical SMILES for 4-(3-aminopyrrolidin-1-yl)-N-methylpyridine-2-carboxamide is CNC(=O)c1cc(N2CCC(N)C2)ccn1.
What is the InChIKey of 4-(3-aminopyrrolidin-1-yl)-N-methylpyridine-2-carboxamide?
The InChIKey is NGRSOFSXWWPYRU-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H16N4O/c1-13-11(16)10-6-9(2-4-14-10)15-5-3-8(12)7-15/h2,4,6,8H,3,5,7,12H2,1H3,(H,13,16).
What are the key properties of 4-(3-aminopyrrolidin-1-yl)-N-methylpyridine-2-carboxamide?
4-(3-aminopyrrolidin-1-yl)-N-methylpyridine-2-carboxamide has a molecular weight of 220.28 g/mol, XLogP of -0.02, 2 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(3-aminopyrrolidin-1-yl)-N-methylpyridine-2-carboxamide is sourced from PubChem (CID 62067734), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).