1-[(6-amino-2-pyridinyl)methyl]pyrrolidine-2-carboxamide

C11H16N4O — CID 79243973

IUPAC1-[(6-amino-2-pyridinyl)methyl]pyrrolidine-2-carboxamide
SMILESNC(=O)C1CCCN1Cc1cccc(N)n1
InChIInChI=1S/C11H16N4O/c12-10-5-1-3-8(14-10)7-15-6-2-4-9(15)11(13)16/h1,3,5,9H,2,4,6-7H2,(H2,12,14)(H2,13,16)
InChIKeyHITPYCWUFHMVRX-UHFFFAOYSA-N
MW220.28 g/mol
LogP0.11
Rot. Bonds3

About 1-[(6-amino-2-pyridinyl)methyl]pyrrolidine-2-carboxamide

1-[(6-amino-2-pyridinyl)methyl]pyrrolidine-2-carboxamide (PubChem CID 79243973) has the molecular formula C11H16N4O and a molecular weight of 220.28 g/mol. Its IUPAC name is 1-[(6-amino-2-pyridinyl)methyl]pyrrolidine-2-carboxamide.

Molecular Properties

Compound Name1-[(6-amino-2-pyridinyl)methyl]pyrrolidine-2-carboxamide
PubChem CID79243973
Molecular FormulaC11H16N4O
Molecular Weight220.28 g/mol
Exact Mass220.13
IUPAC Name1-[(6-amino-2-pyridinyl)methyl]pyrrolidine-2-carboxamide
SMILESNC(=O)C1CCCN1Cc1cccc(N)n1
InChIInChI=1S/C11H16N4O/c12-10-5-1-3-8(14-10)7-15-6-2-4-9(15)11(13)16/h1,3,5,9H,2,4,6-7H2,(H2,12,14)(H2,13,16)
InChIKeyHITPYCWUFHMVRX-UHFFFAOYSA-N
XLogP0.11
TPSA85.24 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500220.28
LogP ≤ 50.11
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

1-[(4-amino-2-pyridinyl)methyl]pyrrolidine-2-carboxamide
CID 79244972
1-(naphthalen-1-ylmethyl)pyrrolidine-2-carboxamide
CID 142687635
1-[(2-phenyl-1,3-thiazol-4-yl)methyl]pyrrolidine-2-carboxamide
CID 154828970
1-[(4-aminophenyl)methyl]pyrrolidine-2-carboxamide
CID 43212133
(2R)-1-benzylpyrrolidine-2-carboxamide;hydrochloride
CID 141477985
1-[(6-amino-2-pyridinyl)methyl]piperidine-3-carboxylic acid
CID 18771697
1-[(1-phenyl-1,2,4-triazol-3-yl)methyl]pyrrolidine-2-carboxamide
CID 75398987
(2R)-1-[(1-phenyl-1,2,4-triazol-3-yl)methyl]pyrrolidine-2-carboxamide
CID 97158502
(2R)-1-[(2-phenyl-1,3-thiazol-4-yl)methyl]piperidine-2-carboxamide
CID 94014669
(2S)-1-(imidazo[1,2-a]pyridin-2-ylmethyl)piperidine-2-carboxamide
CID 95173777
1-[[3-(aminomethyl)-2-fluorophenyl]methyl]piperidine-2-carboxamide
CID 107113264
1-[(3,6-dichloro-2-pyridinyl)methyl]pyrrolidine-2-carboxamide
CID 62890575

Frequently Asked Questions

What is the IUPAC name of 1-[(6-amino-2-pyridinyl)methyl]pyrrolidine-2-carboxamide?
The IUPAC name of 1-[(6-amino-2-pyridinyl)methyl]pyrrolidine-2-carboxamide (CID 79243973) is 1-[(6-amino-2-pyridinyl)methyl]pyrrolidine-2-carboxamide.
What is the SMILES notation for 1-[(6-amino-2-pyridinyl)methyl]pyrrolidine-2-carboxamide?
The canonical SMILES for 1-[(6-amino-2-pyridinyl)methyl]pyrrolidine-2-carboxamide is NC(=O)C1CCCN1Cc1cccc(N)n1.
What is the InChIKey of 1-[(6-amino-2-pyridinyl)methyl]pyrrolidine-2-carboxamide?
The InChIKey is HITPYCWUFHMVRX-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H16N4O/c12-10-5-1-3-8(14-10)7-15-6-2-4-9(15)11(13)16/h1,3,5,9H,2,4,6-7H2,(H2,12,14)(H2,13,16).
What are the key properties of 1-[(6-amino-2-pyridinyl)methyl]pyrrolidine-2-carboxamide?
1-[(6-amino-2-pyridinyl)methyl]pyrrolidine-2-carboxamide has a molecular weight of 220.28 g/mol, XLogP of 0.11, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[(6-amino-2-pyridinyl)methyl]pyrrolidine-2-carboxamide is sourced from PubChem (CID 79243973), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).