3-methyl-N,N-dipropylpent-3-en-1-amine

C12H25N — CID 141081847

IUPAC3-methyl-N,N-dipropylpent-3-en-1-amine
SMILESCC=C(C)CCN(CCC)CCC
InChIInChI=1S/C12H25N/c1-5-9-13(10-6-2)11-8-12(4)7-3/h7H,5-6,8-11H2,1-4H3
InChIKeyMOTPJOKHCLHEGH-UHFFFAOYSA-N
MW183.34 g/mol
LogP3.46
Rot. Bonds7

About 3-methyl-N,N-dipropylpent-3-en-1-amine

3-methyl-N,N-dipropylpent-3-en-1-amine (PubChem CID 141081847) has the molecular formula C12H25N and a molecular weight of 183.34 g/mol. Its IUPAC name is 3-methyl-N,N-dipropylpent-3-en-1-amine.

Molecular Properties

Compound Name3-methyl-N,N-dipropylpent-3-en-1-amine
PubChem CID141081847
Molecular FormulaC12H25N
Molecular Weight183.34 g/mol
Exact Mass183.20
IUPAC Name3-methyl-N,N-dipropylpent-3-en-1-amine
SMILESCC=C(C)CCN(CCC)CCC
InChIInChI=1S/C12H25N/c1-5-9-13(10-6-2)11-8-12(4)7-3/h7H,5-6,8-11H2,1-4H3
InChIKeyMOTPJOKHCLHEGH-UHFFFAOYSA-N
XLogP3.46
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds7
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500183.34
LogP ≤ 53.46
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

2,6-Octadien-1-amine, N,N-diethyl-3,7-dimethyl-, (2E)-
CID 6390621
n,n-Diethyl-3.7-dimethyl-2.6-octadiene-1-amine
CID 324495
4-ethyl-1-methyl-3,6-dihydro-2H-pyridine
CID 21345321
1,5-Diethyl-1,2,3,6-tetrahydropyridine
CID 641110
Pyridine, 1,2,3,6-tetrahydro-1,4-dimethyl-
CID 11389372
4-Hexenylamine, N-ethyl-N,1,5-trimethyl-
CID 57940
N,N-Diethylazasqualene
CID 6439792
(Z)-N,N-Diethyl-3,7-dimethylocta-2,6-dien-1-amine
CID 6243343
Pyridine, 1,2,3,6-tetrahydro-1,5-dimethyl-
CID 12227310
Pyridine, 1,2,5,6-tetrahydro-1,2,4-trimethyl-
CID 23423765
N,N-dimethylamino-4-methyl-pentene-3
CID 12545385
1-(3,7-Dimethylocta-2,6-dienyl)pyrrolidine
CID 72951919

Frequently Asked Questions

What is the IUPAC name of 3-methyl-N,N-dipropylpent-3-en-1-amine?
The IUPAC name of 3-methyl-N,N-dipropylpent-3-en-1-amine (CID 141081847) is 3-methyl-N,N-dipropylpent-3-en-1-amine.
What is the SMILES notation for 3-methyl-N,N-dipropylpent-3-en-1-amine?
The canonical SMILES for 3-methyl-N,N-dipropylpent-3-en-1-amine is CC=C(C)CCN(CCC)CCC.
What is the InChIKey of 3-methyl-N,N-dipropylpent-3-en-1-amine?
The InChIKey is MOTPJOKHCLHEGH-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H25N/c1-5-9-13(10-6-2)11-8-12(4)7-3/h7H,5-6,8-11H2,1-4H3.
What are the key properties of 3-methyl-N,N-dipropylpent-3-en-1-amine?
3-methyl-N,N-dipropylpent-3-en-1-amine has a molecular weight of 183.34 g/mol, XLogP of 3.46, 7 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methyl-N,N-dipropylpent-3-en-1-amine is sourced from PubChem (CID 141081847), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).