N-(cyclopropylmethyl)pentan-1-amine

C9H19N — CID 28566810

IUPACN-(cyclopropylmethyl)pentan-1-amine
SMILESCCCCCNCC1CC1
InChIInChI=1S/C9H19N/c1-2-3-4-7-10-8-9-5-6-9/h9-10H,2-8H2,1H3
InChIKeyWQFTZVBIXIMDSP-UHFFFAOYSA-N
MW141.26 g/mol
LogP2.18
Rot. Bonds6

About N-(cyclopropylmethyl)pentan-1-amine

N-(cyclopropylmethyl)pentan-1-amine (PubChem CID 28566810) has the molecular formula C9H19N and a molecular weight of 141.26 g/mol. Its IUPAC name is N-(cyclopropylmethyl)pentan-1-amine.

Molecular Properties

Compound NameN-(cyclopropylmethyl)pentan-1-amine
PubChem CID28566810
Molecular FormulaC9H19N
Molecular Weight141.26 g/mol
Exact Mass141.15
IUPAC NameN-(cyclopropylmethyl)pentan-1-amine
SMILESCCCCCNCC1CC1
InChIInChI=1S/C9H19N/c1-2-3-4-7-10-8-9-5-6-9/h9-10H,2-8H2,1H3
InChIKeyWQFTZVBIXIMDSP-UHFFFAOYSA-N
XLogP2.18
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds6
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500141.26
LogP ≤ 52.18
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

N-[(4-methylcyclohexyl)methyl]decan-1-amine
CID 63490905
N-[(4-ethylcyclohexyl)methyl]decan-1-amine
CID 63492900
N-(cyclobutylmethyl)heptan-1-amine
CID 43298237
N-(cyclopentylmethyl)decan-1-amine
CID 63489737
N'-(butoxymethyl)-N-(cyclopropylmethyl)butane-1,4-diamine
CID 118055067
3-[(heptylamino)methyl]cyclopentan-1-ol
CID 106120745
N-(piperidin-4-ylmethyl)pentadecan-1-amine;dihydrochloride
CID 11696932
N-[(1-methylpiperidin-4-yl)methyl]decan-1-amine
CID 62223084
N-(azetidin-3-ylmethyl)hexan-1-amine
CID 175786912
3-butoxy-N-[(4-butylcyclohexyl)methyl]propan-1-amine
CID 82223866
N-(cyclopropylmethyl)-N',N'-diethylbutane-1,4-diamine
CID 83960498
3-[(4-methylcyclohexyl)methylamino]propan-1-ol
CID 63243568

Frequently Asked Questions

What is the IUPAC name of N-(cyclopropylmethyl)pentan-1-amine?
The IUPAC name of N-(cyclopropylmethyl)pentan-1-amine (CID 28566810) is N-(cyclopropylmethyl)pentan-1-amine.
What is the SMILES notation for N-(cyclopropylmethyl)pentan-1-amine?
The canonical SMILES for N-(cyclopropylmethyl)pentan-1-amine is CCCCCNCC1CC1.
What is the InChIKey of N-(cyclopropylmethyl)pentan-1-amine?
The InChIKey is WQFTZVBIXIMDSP-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H19N/c1-2-3-4-7-10-8-9-5-6-9/h9-10H,2-8H2,1H3.
What are the key properties of N-(cyclopropylmethyl)pentan-1-amine?
N-(cyclopropylmethyl)pentan-1-amine has a molecular weight of 141.26 g/mol, XLogP of 2.18, 6 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-(cyclopropylmethyl)pentan-1-amine is sourced from PubChem (CID 28566810), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).