2-amino-N-[3-(aminomethyl)-2-pyridinyl]acetamide

C8H12N4O — CID 83618855

IUPAC2-amino-N-[3-(aminomethyl)-2-pyridinyl]acetamide
SMILESNCC(=O)Nc1ncccc1CN
InChIInChI=1S/C8H12N4O/c9-4-6-2-1-3-11-8(6)12-7(13)5-10/h1-3H,4-5,9-10H2,(H,11,12,13)
InChIKeyZYXZCQJXNOVRKE-UHFFFAOYSA-N
MW180.21 g/mol
LogP-0.56
Rot. Bonds3

About 2-amino-N-[3-(aminomethyl)-2-pyridinyl]acetamide

2-amino-N-[3-(aminomethyl)-2-pyridinyl]acetamide (PubChem CID 83618855) has the molecular formula C8H12N4O and a molecular weight of 180.21 g/mol. Its IUPAC name is 2-amino-N-[3-(aminomethyl)-2-pyridinyl]acetamide.

Molecular Properties

Compound Name2-amino-N-[3-(aminomethyl)-2-pyridinyl]acetamide
PubChem CID83618855
Molecular FormulaC8H12N4O
Molecular Weight180.21 g/mol
Exact Mass180.10
IUPAC Name2-amino-N-[3-(aminomethyl)-2-pyridinyl]acetamide
SMILESNCC(=O)Nc1ncccc1CN
InChIInChI=1S/C8H12N4O/c9-4-6-2-1-3-11-8(6)12-7(13)5-10/h1-3H,4-5,9-10H2,(H,11,12,13)
InChIKeyZYXZCQJXNOVRKE-UHFFFAOYSA-N
XLogP-0.56
TPSA94.03 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500180.21
LogP ≤ 5-0.56
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Related Compounds

N-[3-(aminomethyl)-2-pyridinyl]-2-thiophen-2-ylacetamide
CID 82344031
N-[3-(aminomethyl)-2-pyridinyl]-2-cyclohexylacetamide
CID 82344080
2-amino-N-[2-[(3-hydroxy-2-pyridinyl)amino]-2-oxoethyl]acetamide
CID 115597399
3-amino-N-(3-hydroxy-2-pyridinyl)propanamide
CID 110460198
N-[3-(aminomethyl)-2-pyridinyl]ethanesulfonamide
CID 66677968
N-(3-chloro-2-pyridinyl)-2-phenylacetamide
CID 903998
1-[3-[[3-(aminomethyl)-2-pyridinyl]amino]phenyl]ethanone
CID 82084693
2-[2-(aminomethyl)anilino]pyridine-3-carboxamide
CID 55241412
2-(2-hydroxyphenyl)-N-(3-methyl-2-pyridinyl)acetamide
CID 60615989
[3-(aminomethyl)-2-pyridinyl]methylcarbamic acid
CID 68918958
3-(aminomethyl)-N-(3,5-dimethylphenyl)pyridin-2-amine
CID 82081174
N-(3-chloro-2-pyridinyl)-2-(4-methylphenyl)acetamide
CID 103892864

Frequently Asked Questions

What is the IUPAC name of 2-amino-N-[3-(aminomethyl)-2-pyridinyl]acetamide?
The IUPAC name of 2-amino-N-[3-(aminomethyl)-2-pyridinyl]acetamide (CID 83618855) is 2-amino-N-[3-(aminomethyl)-2-pyridinyl]acetamide.
What is the SMILES notation for 2-amino-N-[3-(aminomethyl)-2-pyridinyl]acetamide?
The canonical SMILES for 2-amino-N-[3-(aminomethyl)-2-pyridinyl]acetamide is NCC(=O)Nc1ncccc1CN.
What is the InChIKey of 2-amino-N-[3-(aminomethyl)-2-pyridinyl]acetamide?
The InChIKey is ZYXZCQJXNOVRKE-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H12N4O/c9-4-6-2-1-3-11-8(6)12-7(13)5-10/h1-3H,4-5,9-10H2,(H,11,12,13).
What are the key properties of 2-amino-N-[3-(aminomethyl)-2-pyridinyl]acetamide?
2-amino-N-[3-(aminomethyl)-2-pyridinyl]acetamide has a molecular weight of 180.21 g/mol, XLogP of -0.56, 3 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-N-[3-(aminomethyl)-2-pyridinyl]acetamide is sourced from PubChem (CID 83618855), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).