cis-(1S,2S)-1-amino-2-cyclopropylcyclopropane-1-carboxamide

C7H12N2O — CID 170054920

IUPACcis-(1S,2S)-1-amino-2-cyclopropylcyclopropane-1-carboxamide
SMILESNC(=O)[C@]1(N)C[C@H]1C1CC1
InChIInChI=1S/C7H12N2O/c8-6(10)7(9)3-5(7)4-1-2-4/h4-5H,1-3,9H2,(H2,8,10)/t5-,7-/m0/s1
InChIKeyOASRNAUEBMATGM-FSPLSTOPSA-N
MW140.19 g/mol
LogP-0.40
Rot. Bonds2

About cis-(1S,2S)-1-amino-2-cyclopropylcyclopropane-1-carboxamide

cis-(1S,2S)-1-amino-2-cyclopropylcyclopropane-1-carboxamide (PubChem CID 170054920) has the molecular formula C7H12N2O and a molecular weight of 140.19 g/mol. Its IUPAC name is cis-(1S,2S)-1-amino-2-cyclopropylcyclopropane-1-carboxamide.

Molecular Properties

Compound Namecis-(1S,2S)-1-amino-2-cyclopropylcyclopropane-1-carboxamide
PubChem CID170054920
Molecular FormulaC7H12N2O
Molecular Weight140.19 g/mol
Exact Mass140.09
IUPAC Namecis-(1S,2S)-1-amino-2-cyclopropylcyclopropane-1-carboxamide
SMILESNC(=O)[C@]1(N)C[C@H]1C1CC1
InChIInChI=1S/C7H12N2O/c8-6(10)7(9)3-5(7)4-1-2-4/h4-5H,1-3,9H2,(H2,8,10)/t5-,7-/m0/s1
InChIKeyOASRNAUEBMATGM-FSPLSTOPSA-N
XLogP-0.40
TPSA69.11 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500140.19
LogP ≤ 5-0.40
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of cis-(1S,2S)-1-amino-2-cyclopropylcyclopropane-1-carboxamide?
The IUPAC name of cis-(1S,2S)-1-amino-2-cyclopropylcyclopropane-1-carboxamide (CID 170054920) is cis-(1S,2S)-1-amino-2-cyclopropylcyclopropane-1-carboxamide.
What is the SMILES notation for cis-(1S,2S)-1-amino-2-cyclopropylcyclopropane-1-carboxamide?
The canonical SMILES for cis-(1S,2S)-1-amino-2-cyclopropylcyclopropane-1-carboxamide is NC(=O)[C@]1(N)C[C@H]1C1CC1.
What is the InChIKey of cis-(1S,2S)-1-amino-2-cyclopropylcyclopropane-1-carboxamide?
The InChIKey is OASRNAUEBMATGM-FSPLSTOPSA-N. The full InChI is InChI=1S/C7H12N2O/c8-6(10)7(9)3-5(7)4-1-2-4/h4-5H,1-3,9H2,(H2,8,10)/t5-,7-/m0/s1.
What are the key properties of cis-(1S,2S)-1-amino-2-cyclopropylcyclopropane-1-carboxamide?
cis-(1S,2S)-1-amino-2-cyclopropylcyclopropane-1-carboxamide has a molecular weight of 140.19 g/mol, XLogP of -0.40, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for cis-(1S,2S)-1-amino-2-cyclopropylcyclopropane-1-carboxamide is sourced from PubChem (CID 170054920), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).