N-(2-cyclopropyl-2-methylpentyl)cyclopropanamine

C12H23N — CID 83159526

IUPACN-(2-cyclopropyl-2-methylpentyl)cyclopropanamine
SMILESCCCC(C)(CNC1CC1)C1CC1
InChIInChI=1S/C12H23N/c1-3-8-12(2,10-4-5-10)9-13-11-6-7-11/h10-11,13H,3-9H2,1-2H3
InChIKeySVMKJAVPWYXXED-UHFFFAOYSA-N
MW181.32 g/mol
LogP2.95
Rot. Bonds6

About N-(2-cyclopropyl-2-methylpentyl)cyclopropanamine

N-(2-cyclopropyl-2-methylpentyl)cyclopropanamine (PubChem CID 83159526) has the molecular formula C12H23N and a molecular weight of 181.32 g/mol. Its IUPAC name is N-(2-cyclopropyl-2-methylpentyl)cyclopropanamine.

Molecular Properties

Compound NameN-(2-cyclopropyl-2-methylpentyl)cyclopropanamine
PubChem CID83159526
Molecular FormulaC12H23N
Molecular Weight181.32 g/mol
Exact Mass181.18
IUPAC NameN-(2-cyclopropyl-2-methylpentyl)cyclopropanamine
SMILESCCCC(C)(CNC1CC1)C1CC1
InChIInChI=1S/C12H23N/c1-3-8-12(2,10-4-5-10)9-13-11-6-7-11/h10-11,13H,3-9H2,1-2H3
InChIKeySVMKJAVPWYXXED-UHFFFAOYSA-N
XLogP2.95
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds6
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500181.32
LogP ≤ 52.95
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

N-(2-cyclopropyl-2-methylbutyl)cyclopropanamine
CID 83160155
N-(2-cyclopropyl-2-methyl-3-trimethylsilylpropyl)cyclopropanamine
CID 106323909
N-(2-cyclopropyl-2-methyl-5-phenylpentyl)cyclopropanamine
CID 83160152
2-cyclopropyl-2-methylpentan-1-ol
CID 83151600
3-[[(4-tert-butylcyclohexyl)amino]methyl]pentan-3-ol
CID 65107819
N-(2-cyclopropyl-2-methyl-4-thiophen-3-ylbutyl)cyclopropanamine
CID 83160154
N-[2-cyclopropyl-4-(2-methoxyphenoxy)-2-methylbutyl]cyclopropanamine
CID 83150520
2-cyclopropyl-1-(cyclopropylamino)butan-2-ol
CID 64919587
N-(2,2-dimethylnonyl)cyclopropanamine
CID 63523416
N-(2,2-dimethyloctyl)cyclopropanamine
CID 62724340
N-[2-cyclopropyl-2-methyl-3-(3-methylphenyl)propyl]cyclopropanamine
CID 83160248
N-[3-(4-bromophenyl)-2-cyclopropyl-2-methylpropyl]cyclopropanamine
CID 83160159

Frequently Asked Questions

What is the IUPAC name of N-(2-cyclopropyl-2-methylpentyl)cyclopropanamine?
The IUPAC name of N-(2-cyclopropyl-2-methylpentyl)cyclopropanamine (CID 83159526) is N-(2-cyclopropyl-2-methylpentyl)cyclopropanamine.
What is the SMILES notation for N-(2-cyclopropyl-2-methylpentyl)cyclopropanamine?
The canonical SMILES for N-(2-cyclopropyl-2-methylpentyl)cyclopropanamine is CCCC(C)(CNC1CC1)C1CC1.
What is the InChIKey of N-(2-cyclopropyl-2-methylpentyl)cyclopropanamine?
The InChIKey is SVMKJAVPWYXXED-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H23N/c1-3-8-12(2,10-4-5-10)9-13-11-6-7-11/h10-11,13H,3-9H2,1-2H3.
What are the key properties of N-(2-cyclopropyl-2-methylpentyl)cyclopropanamine?
N-(2-cyclopropyl-2-methylpentyl)cyclopropanamine has a molecular weight of 181.32 g/mol, XLogP of 2.95, 6 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-cyclopropyl-2-methylpentyl)cyclopropanamine is sourced from PubChem (CID 83159526), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).