N-(cyclopropylmethyl)-N-propylbutan-1-amine

C11H23N — CID 89097130

IUPACN-(cyclopropylmethyl)-N-propylbutan-1-amine
SMILESCCCCN(CCC)CC1CC1
InChIInChI=1S/C11H23N/c1-3-5-9-12(8-4-2)10-11-6-7-11/h11H,3-10H2,1-2H3
InChIKeyGTDPWANHVLFABV-UHFFFAOYSA-N
MW169.31 g/mol
LogP2.91
Rot. Bonds7

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

N-(cyclopropylmethyl)-N-propylbutan-1-amine (PubChem CID 89097130) has the molecular formula C11H23N and a molecular weight of 169.31 g/mol. Its IUPAC name is N-(cyclopropylmethyl)-N-propylbutan-1-amine.

Molecular Properties

Compound NameN-(cyclopropylmethyl)-N-propylbutan-1-amine
PubChem CID89097130
Molecular FormulaC11H23N
Molecular Weight169.31 g/mol
Exact Mass169.18
IUPAC NameN-(cyclopropylmethyl)-N-propylbutan-1-amine
SMILESCCCCN(CCC)CC1CC1
InChIInChI=1S/C11H23N/c1-3-5-9-12(8-4-2)10-11-6-7-11/h11H,3-10H2,1-2H3
InChIKeyGTDPWANHVLFABV-UHFFFAOYSA-N
XLogP2.91
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds7
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500169.31
LogP ≤ 52.91
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

N-(cyclopropylmethyl)-N-propylpentan-1-amine
CID 89142496
N-(2-bromoethyl)-N-(cyclopropylmethyl)propan-1-amine
CID 61445615
3-[(dibutylamino)methyl]cyclopentan-1-amine
CID 66008000
4-[cyclopropylmethyl(propyl)amino]butanoic acid
CID 61441614
N-butyl-N-(piperidin-4-ylmethyl)pentan-1-amine
CID 94810456
N-(cyclopropylmethyl)-3-methyl-N-propylbutan-1-amine
CID 21355618
N'-(cyclopropylmethyl)-2,2-dimethyl-N'-propylpentane-1,5-diamine
CID 65254511
N'-(cyclopropylmethyl)-2,2-dimethyl-N'-propylhexane-1,6-diamine
CID 106707901
4-[cyclohexylmethyl(propyl)amino]butan-1-ol
CID 110931716
N-[(1-ethylpiperidin-4-yl)methyl]-N-propylpropan-1-amine
CID 170705762
N,N'-bis(cyclopropylmethyl)-N'-propylethane-1,2-diamine
CID 61443394
N,N-dipropylbutan-1-amine;hydrofluoride
CID 19783533

Frequently Asked Questions

What is the IUPAC name of N-(cyclopropylmethyl)-N-propylbutan-1-amine?
The IUPAC name of N-(cyclopropylmethyl)-N-propylbutan-1-amine (CID 89097130) is N-(cyclopropylmethyl)-N-propylbutan-1-amine.
What is the SMILES notation for N-(cyclopropylmethyl)-N-propylbutan-1-amine?
The canonical SMILES for N-(cyclopropylmethyl)-N-propylbutan-1-amine is CCCCN(CCC)CC1CC1.
What is the InChIKey of N-(cyclopropylmethyl)-N-propylbutan-1-amine?
The InChIKey is GTDPWANHVLFABV-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H23N/c1-3-5-9-12(8-4-2)10-11-6-7-11/h11H,3-10H2,1-2H3.
What are the key properties of N-(cyclopropylmethyl)-N-propylbutan-1-amine?
N-(cyclopropylmethyl)-N-propylbutan-1-amine has a molecular weight of 169.31 g/mol, XLogP of 2.91, 7 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-(cyclopropylmethyl)-N-propylbutan-1-amine is sourced from PubChem (CID 89097130), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).