2-amino-N-[(1-phenylcyclopropyl)methyl]acetamide

C12H16N2O — CID 110459326

IUPAC2-amino-N-[(1-phenylcyclopropyl)methyl]acetamide
SMILESNCC(=O)NCC1(c2ccccc2)CC1
InChIInChI=1S/C12H16N2O/c13-8-11(15)14-9-12(6-7-12)10-4-2-1-3-5-10/h1-5H,6-9,13H2,(H,14,15)
InChIKeyKEHNCBPNNBBTEE-UHFFFAOYSA-N
MW204.27 g/mol
LogP0.79
Rot. Bonds4

About 2-amino-N-[(1-phenylcyclopropyl)methyl]acetamide

2-amino-N-[(1-phenylcyclopropyl)methyl]acetamide (PubChem CID 110459326) has the molecular formula C12H16N2O and a molecular weight of 204.27 g/mol. Its IUPAC name is 2-amino-N-[(1-phenylcyclopropyl)methyl]acetamide.

Molecular Properties

Compound Name2-amino-N-[(1-phenylcyclopropyl)methyl]acetamide
PubChem CID110459326
Molecular FormulaC12H16N2O
Molecular Weight204.27 g/mol
Exact Mass204.13
IUPAC Name2-amino-N-[(1-phenylcyclopropyl)methyl]acetamide
SMILESNCC(=O)NCC1(c2ccccc2)CC1
InChIInChI=1S/C12H16N2O/c13-8-11(15)14-9-12(6-7-12)10-4-2-1-3-5-10/h1-5H,6-9,13H2,(H,14,15)
InChIKeyKEHNCBPNNBBTEE-UHFFFAOYSA-N
XLogP0.79
TPSA55.12 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500204.27
LogP ≤ 50.79
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

3-amino-N-[(1-phenylcyclopropyl)methyl]propanamide
CID 110460210
3-oxo-N-[(1-phenylcyclopropyl)methyl]butanamide
CID 110470652
3-amino-N-[(1-phenylcyclobutyl)methyl]propanamide
CID 110460227
2-amino-N-[[(1R,4S,5S)-4-hydroxy-5-(4-hydroxypiperidin-1-yl)-1-phenylcycloheptyl]methyl]acetamide
CID 110160088
ethyl 3-oxo-3-[(1-phenylcyclopropyl)methylamino]propanoate
CID 110474208
N-[2-oxo-2-[(1-phenylcyclopropyl)methylamino]ethyl]-2-phenylacetamide
CID 42145846
1-methoxy-3-[(1-phenylcyclopropyl)methyl]urea
CID 47159768
2-amino-N-[[1-(2-methylphenyl)cyclopropyl]methyl]acetamide;hydrochloride
CID 119315817
4-(aminomethyl)-N-[(1-phenylcyclopropyl)methyl]benzamide
CID 82546336
3-[methyl-[2-oxo-2-[(1-phenylcyclopropyl)methylamino]ethyl]amino]propanoic acid
CID 119911689
2-[[2-(dimethylamino)-2-oxoethyl]-methylamino]-N-[(1-phenylcyclopropyl)methyl]acetamide
CID 34557487
2,2,2-trifluoro-N-[(1-phenylcyclopropyl)methyl]acetamide
CID 110443182

Frequently Asked Questions

What is the IUPAC name of 2-amino-N-[(1-phenylcyclopropyl)methyl]acetamide?
The IUPAC name of 2-amino-N-[(1-phenylcyclopropyl)methyl]acetamide (CID 110459326) is 2-amino-N-[(1-phenylcyclopropyl)methyl]acetamide.
What is the SMILES notation for 2-amino-N-[(1-phenylcyclopropyl)methyl]acetamide?
The canonical SMILES for 2-amino-N-[(1-phenylcyclopropyl)methyl]acetamide is NCC(=O)NCC1(c2ccccc2)CC1.
What is the InChIKey of 2-amino-N-[(1-phenylcyclopropyl)methyl]acetamide?
The InChIKey is KEHNCBPNNBBTEE-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H16N2O/c13-8-11(15)14-9-12(6-7-12)10-4-2-1-3-5-10/h1-5H,6-9,13H2,(H,14,15).
What are the key properties of 2-amino-N-[(1-phenylcyclopropyl)methyl]acetamide?
2-amino-N-[(1-phenylcyclopropyl)methyl]acetamide has a molecular weight of 204.27 g/mol, XLogP of 0.79, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-N-[(1-phenylcyclopropyl)methyl]acetamide is sourced from PubChem (CID 110459326), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).