N-(3-amino-3-oxopropyl)-2-methylcyclopropane-1-carboxamide

C8H14N2O2 — CID 43350590

IUPACN-(3-amino-3-oxopropyl)-2-methylcyclopropane-1-carboxamide
SMILESCC1CC1C(=O)NCCC(N)=O
InChIInChI=1S/C8H14N2O2/c1-5-4-6(5)8(12)10-3-2-7(9)11/h5-6H,2-4H2,1H3,(H2,9,11)(H,10,12)
InChIKeyKZIXUVSYJZSHGS-UHFFFAOYSA-N
MW170.21 g/mol
LogP-0.37
Rot. Bonds4

About N-(3-amino-3-oxopropyl)-2-methylcyclopropane-1-carboxamide

N-(3-amino-3-oxopropyl)-2-methylcyclopropane-1-carboxamide (PubChem CID 43350590) has the molecular formula C8H14N2O2 and a molecular weight of 170.21 g/mol. Its IUPAC name is N-(3-amino-3-oxopropyl)-2-methylcyclopropane-1-carboxamide.

Molecular Properties

Compound NameN-(3-amino-3-oxopropyl)-2-methylcyclopropane-1-carboxamide
PubChem CID43350590
Molecular FormulaC8H14N2O2
Molecular Weight170.21 g/mol
Exact Mass170.11
IUPAC NameN-(3-amino-3-oxopropyl)-2-methylcyclopropane-1-carboxamide
SMILESCC1CC1C(=O)NCCC(N)=O
InChIInChI=1S/C8H14N2O2/c1-5-4-6(5)8(12)10-3-2-7(9)11/h5-6H,2-4H2,1H3,(H2,9,11)(H,10,12)
InChIKeyKZIXUVSYJZSHGS-UHFFFAOYSA-N
XLogP-0.37
TPSA72.19 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500170.21
LogP ≤ 5-0.37
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

cis-(1R,2S)-2-methyl-N-propylcyclopropane-1-carboxamide
CID 95357811
N-(3-aminopropyl)-2-methylcyclopropane-1-carboxamide
CID 24711673
2-methyl-N-[2-(methylamino)ethyl]cyclopropane-1-carboxamide
CID 62657204
4-[(2-methylcyclopropanecarbonyl)amino]butanoic acid
CID 16772815
N-[3-(tert-butylamino)-3-oxopropyl]-2-methylcyclopropane-1-carboxamide
CID 71942014
(1R,6R)-6-[(3-amino-3-oxopropyl)carbamoyl]cyclohex-3-ene-1-carboxylic acid
CID 93241610
2-[(4-amino-4-oxobutyl)carbamoyl]cyclopropane-1-carboxylic acid
CID 60864450
2-methyl-N-[(E)-pent-3-enyl]cyclopropane-1-carboxamide
CID 115627883
N-(4-amino-4-oxobutyl)-4-methylpyrrolidine-3-carboxamide
CID 63714298
N-(6-hydroxyhexyl)-2-methylcyclopropane-1-carboxamide
CID 103919117
3-[methyl-[3-[(2-methylcyclopropanecarbonyl)amino]propanoyl]amino]propanoic acid
CID 60989213
N-[3-[3-hydroxybutyl(methyl)amino]-3-oxopropyl]-2-methylcyclopropane-1-carboxamide
CID 115691583

Frequently Asked Questions

What is the IUPAC name of N-(3-amino-3-oxopropyl)-2-methylcyclopropane-1-carboxamide?
The IUPAC name of N-(3-amino-3-oxopropyl)-2-methylcyclopropane-1-carboxamide (CID 43350590) is N-(3-amino-3-oxopropyl)-2-methylcyclopropane-1-carboxamide.
What is the SMILES notation for N-(3-amino-3-oxopropyl)-2-methylcyclopropane-1-carboxamide?
The canonical SMILES for N-(3-amino-3-oxopropyl)-2-methylcyclopropane-1-carboxamide is CC1CC1C(=O)NCCC(N)=O.
What is the InChIKey of N-(3-amino-3-oxopropyl)-2-methylcyclopropane-1-carboxamide?
The InChIKey is KZIXUVSYJZSHGS-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H14N2O2/c1-5-4-6(5)8(12)10-3-2-7(9)11/h5-6H,2-4H2,1H3,(H2,9,11)(H,10,12).
What are the key properties of N-(3-amino-3-oxopropyl)-2-methylcyclopropane-1-carboxamide?
N-(3-amino-3-oxopropyl)-2-methylcyclopropane-1-carboxamide has a molecular weight of 170.21 g/mol, XLogP of -0.37, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-amino-3-oxopropyl)-2-methylcyclopropane-1-carboxamide is sourced from PubChem (CID 43350590), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).