N-(cyclopropylmethyl)-N-propylpentan-1-amine

C12H25N — CID 89142496

IUPACN-(cyclopropylmethyl)-N-propylpentan-1-amine
SMILESCCCCCN(CCC)CC1CC1
InChIInChI=1S/C12H25N/c1-3-5-6-10-13(9-4-2)11-12-7-8-12/h12H,3-11H2,1-2H3
InChIKeyRSKNZSLIXDYJRW-UHFFFAOYSA-N
MW183.34 g/mol
LogP3.30
Rot. Bonds8

About N-(cyclopropylmethyl)-N-propylpentan-1-amine

N-(cyclopropylmethyl)-N-propylpentan-1-amine (PubChem CID 89142496) has the molecular formula C12H25N and a molecular weight of 183.34 g/mol. Its IUPAC name is N-(cyclopropylmethyl)-N-propylpentan-1-amine.

Molecular Properties

Compound NameN-(cyclopropylmethyl)-N-propylpentan-1-amine
PubChem CID89142496
Molecular FormulaC12H25N
Molecular Weight183.34 g/mol
Exact Mass183.20
IUPAC NameN-(cyclopropylmethyl)-N-propylpentan-1-amine
SMILESCCCCCN(CCC)CC1CC1
InChIInChI=1S/C12H25N/c1-3-5-6-10-13(9-4-2)11-12-7-8-12/h12H,3-11H2,1-2H3
InChIKeyRSKNZSLIXDYJRW-UHFFFAOYSA-N
XLogP3.30
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds8
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500183.34
LogP ≤ 53.30
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

N-(cyclopropylmethyl)-N-propylbutan-1-amine
CID 89097130
N-butyl-N-(piperidin-4-ylmethyl)pentan-1-amine
CID 94810456
N-(2-bromoethyl)-N-(cyclopropylmethyl)propan-1-amine
CID 61445615
4-[cyclopropylmethyl(propyl)amino]butanoic acid
CID 61441614
4-[cyclohexylmethyl(propyl)amino]butan-1-ol
CID 110931716
N'-(cyclopropylmethyl)-2,2-dimethyl-N'-propylhexane-1,6-diamine
CID 106707901
N-(cyclopropylmethyl)-3-methyl-N-propylbutan-1-amine
CID 21355618
N'-(cyclopropylmethyl)-2,2-dimethyl-N'-propylpentane-1,5-diamine
CID 65254511
3-[(dibutylamino)methyl]cyclopentan-1-amine
CID 66008000
N-ethyl-N-(piperidin-4-ylmethyl)hexan-1-amine
CID 79715887
N-dodecyl-N-propylpentadecan-1-amine;tridecane
CID 177194050
6-[cyclopropylmethyl(propyl)amino]-2-methyl-2-(methylamino)hexan-1-ol
CID 64826327

Frequently Asked Questions

What is the IUPAC name of N-(cyclopropylmethyl)-N-propylpentan-1-amine?
The IUPAC name of N-(cyclopropylmethyl)-N-propylpentan-1-amine (CID 89142496) is N-(cyclopropylmethyl)-N-propylpentan-1-amine.
What is the SMILES notation for N-(cyclopropylmethyl)-N-propylpentan-1-amine?
The canonical SMILES for N-(cyclopropylmethyl)-N-propylpentan-1-amine is CCCCCN(CCC)CC1CC1.
What is the InChIKey of N-(cyclopropylmethyl)-N-propylpentan-1-amine?
The InChIKey is RSKNZSLIXDYJRW-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H25N/c1-3-5-6-10-13(9-4-2)11-12-7-8-12/h12H,3-11H2,1-2H3.
What are the key properties of N-(cyclopropylmethyl)-N-propylpentan-1-amine?
N-(cyclopropylmethyl)-N-propylpentan-1-amine has a molecular weight of 183.34 g/mol, XLogP of 3.30, 8 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-(cyclopropylmethyl)-N-propylpentan-1-amine is sourced from PubChem (CID 89142496), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).