N-(1-amino-2-methylbutan-2-yl)cyclopropanecarboxamide

C9H18N2O — CID 64551544

IUPACN-(1-amino-2-methylbutan-2-yl)cyclopropanecarboxamide
SMILESCCC(C)(CN)NC(=O)C1CC1
InChIInChI=1S/C9H18N2O/c1-3-9(2,6-10)11-8(12)7-4-5-7/h7H,3-6,10H2,1-2H3,(H,11,12)
InChIKeyQWVKSZUDHZQLCH-UHFFFAOYSA-N
MW170.26 g/mol
LogP0.64
Rot. Bonds4

About N-(1-amino-2-methylbutan-2-yl)cyclopropanecarboxamide

N-(1-amino-2-methylbutan-2-yl)cyclopropanecarboxamide (PubChem CID 64551544) has the molecular formula C9H18N2O and a molecular weight of 170.26 g/mol. Its IUPAC name is N-(1-amino-2-methylbutan-2-yl)cyclopropanecarboxamide.

Molecular Properties

Compound NameN-(1-amino-2-methylbutan-2-yl)cyclopropanecarboxamide
PubChem CID64551544
Molecular FormulaC9H18N2O
Molecular Weight170.26 g/mol
Exact Mass170.14
IUPAC NameN-(1-amino-2-methylbutan-2-yl)cyclopropanecarboxamide
SMILESCCC(C)(CN)NC(=O)C1CC1
InChIInChI=1S/C9H18N2O/c1-3-9(2,6-10)11-8(12)7-4-5-7/h7H,3-6,10H2,1-2H3,(H,11,12)
InChIKeyQWVKSZUDHZQLCH-UHFFFAOYSA-N
XLogP0.64
TPSA55.12 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500170.26
LogP ≤ 50.64
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

N-(1-amino-2-methylbutan-2-yl)cycloheptanecarboxamide
CID 64551753
N-(1-chloro-2-methylbutan-2-yl)cyclopropanecarboxamide
CID 114303630
N-(1-bromo-2-methylbutan-2-yl)cyclopentanecarboxamide
CID 114314310
N-(1-amino-2-methylbutan-2-yl)adamantane-2-carboxamide
CID 81096337
N-(1-chloro-2-methylbutan-2-yl)cyclohexanecarboxamide
CID 114303618
N-(1-bromo-3-methylpentan-3-yl)-4-tert-butylcyclohexane-1-carboxamide
CID 106169068
N-(1-amino-2,4-dimethylpentan-2-yl)cycloheptanecarboxamide;hydrochloride
CID 119599741
1-(1-amino-2-methylbutan-2-yl)-3-cyclobutylurea
CID 116658153
N-(1-chloro-3-methylpentan-3-yl)cyclobutanecarboxamide
CID 106168508
N-(1-bromo-3-methylpentan-3-yl)oxane-4-carboxamide
CID 106169351
N-(1-amino-2-methyl-1-oxopropan-2-yl)cyclopropanecarboxamide
CID 61226670
N-[3-(aminomethyl)pentan-3-yl]oxane-4-carboxamide;hydrochloride
CID 119568602

Frequently Asked Questions

What is the IUPAC name of N-(1-amino-2-methylbutan-2-yl)cyclopropanecarboxamide?
The IUPAC name of N-(1-amino-2-methylbutan-2-yl)cyclopropanecarboxamide (CID 64551544) is N-(1-amino-2-methylbutan-2-yl)cyclopropanecarboxamide.
What is the SMILES notation for N-(1-amino-2-methylbutan-2-yl)cyclopropanecarboxamide?
The canonical SMILES for N-(1-amino-2-methylbutan-2-yl)cyclopropanecarboxamide is CCC(C)(CN)NC(=O)C1CC1.
What is the InChIKey of N-(1-amino-2-methylbutan-2-yl)cyclopropanecarboxamide?
The InChIKey is QWVKSZUDHZQLCH-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H18N2O/c1-3-9(2,6-10)11-8(12)7-4-5-7/h7H,3-6,10H2,1-2H3,(H,11,12).
What are the key properties of N-(1-amino-2-methylbutan-2-yl)cyclopropanecarboxamide?
N-(1-amino-2-methylbutan-2-yl)cyclopropanecarboxamide has a molecular weight of 170.26 g/mol, XLogP of 0.64, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-amino-2-methylbutan-2-yl)cyclopropanecarboxamide is sourced from PubChem (CID 64551544), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).