1-(aminomethyl)-N-methylcyclopropane-1-carboxamide

C6H12N2O — CID 59252099

IUPAC1-(aminomethyl)-N-methylcyclopropane-1-carboxamide
SMILESCNC(=O)C1(CN)CC1
InChIInChI=1S/C6H12N2O/c1-8-5(9)6(4-7)2-3-6/h2-4,7H2,1H3,(H,8,9)
InChIKeyTVXCXVPYOTWTHX-UHFFFAOYSA-N
MW128.17 g/mol
LogP-0.53
Rot. Bonds2

About 1-(aminomethyl)-N-methylcyclopropane-1-carboxamide

1-(aminomethyl)-N-methylcyclopropane-1-carboxamide (PubChem CID 59252099) has the molecular formula C6H12N2O and a molecular weight of 128.17 g/mol. Its IUPAC name is 1-(aminomethyl)-N-methylcyclopropane-1-carboxamide.

Molecular Properties

Compound Name1-(aminomethyl)-N-methylcyclopropane-1-carboxamide
PubChem CID59252099
Molecular FormulaC6H12N2O
Molecular Weight128.17 g/mol
Exact Mass128.09
IUPAC Name1-(aminomethyl)-N-methylcyclopropane-1-carboxamide
SMILESCNC(=O)C1(CN)CC1
InChIInChI=1S/C6H12N2O/c1-8-5(9)6(4-7)2-3-6/h2-4,7H2,1H3,(H,8,9)
InChIKeyTVXCXVPYOTWTHX-UHFFFAOYSA-N
XLogP-0.53
TPSA55.12 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500128.17
LogP ≤ 5-0.53
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 1-(aminomethyl)-N-methylcyclopropane-1-carboxamide?
The IUPAC name of 1-(aminomethyl)-N-methylcyclopropane-1-carboxamide (CID 59252099) is 1-(aminomethyl)-N-methylcyclopropane-1-carboxamide.
What is the SMILES notation for 1-(aminomethyl)-N-methylcyclopropane-1-carboxamide?
The canonical SMILES for 1-(aminomethyl)-N-methylcyclopropane-1-carboxamide is CNC(=O)C1(CN)CC1.
What is the InChIKey of 1-(aminomethyl)-N-methylcyclopropane-1-carboxamide?
The InChIKey is TVXCXVPYOTWTHX-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H12N2O/c1-8-5(9)6(4-7)2-3-6/h2-4,7H2,1H3,(H,8,9).
What are the key properties of 1-(aminomethyl)-N-methylcyclopropane-1-carboxamide?
1-(aminomethyl)-N-methylcyclopropane-1-carboxamide has a molecular weight of 128.17 g/mol, XLogP of -0.53, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(aminomethyl)-N-methylcyclopropane-1-carboxamide is sourced from PubChem (CID 59252099), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).