4-methyl-N-propan-2-ylpent-2-en-1-amine

C9H19N — CID 79347587

IUPAC4-methyl-N-propan-2-ylpent-2-en-1-amine
SMILESCC(C)C=CCNC(C)C
InChIInChI=1S/C9H19N/c1-8(2)6-5-7-10-9(3)4/h5-6,8-10H,7H2,1-4H3
InChIKeySTORPARNRDMIST-UHFFFAOYSA-N
MW141.26 g/mol
LogP2.20
Rot. Bonds4

About 4-methyl-N-propan-2-ylpent-2-en-1-amine

4-methyl-N-propan-2-ylpent-2-en-1-amine (PubChem CID 79347587) has the molecular formula C9H19N and a molecular weight of 141.26 g/mol. Its IUPAC name is 4-methyl-N-propan-2-ylpent-2-en-1-amine.

Molecular Properties

Compound Name4-methyl-N-propan-2-ylpent-2-en-1-amine
PubChem CID79347587
Molecular FormulaC9H19N
Molecular Weight141.26 g/mol
Exact Mass141.15
IUPAC Name4-methyl-N-propan-2-ylpent-2-en-1-amine
SMILESCC(C)C=CCNC(C)C
InChIInChI=1S/C9H19N/c1-8(2)6-5-7-10-9(3)4/h5-6,8-10H,7H2,1-4H3
InChIKeySTORPARNRDMIST-UHFFFAOYSA-N
XLogP2.20
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500141.26
LogP ≤ 52.20
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

2,5-Dimethyl-3-pyrroline
CID 101066
6-Methyl-N-(prop-2-en-1-yl)hept-5-en-2-amine
CID 20850
2,4,6-Cycloheptatriene-1-ethylamine
CID 58094
(2R,5R)-2,5-dimethyl-2,5-dihydro-1H-pyrrole
CID 7003739
2-methyl-2,5-dihydro-1H-pyrrole
CID 21492268
Pyridine, 1,2,5,6-tetrahydro-2-methyl-
CID 5231252
(2S,5R)-2,5-dimethyl-2,5-dihydro-1H-pyrrole
CID 7003737
(5E)-6-fluoro-N,4-dimethylnona-1,5-dien-3-amine
CID 134365669
(E,2S)-N-ethyl-3-fluorohex-3-en-2-amine
CID 139323857
(Z)-N-ethyl-3-fluoro-4-methylpent-2-en-1-amine
CID 168189653
(E)-4,5-difluoro-N-propan-2-ylhex-3-en-2-amine
CID 169932770
(2S,6S)-6-(2-methylpropyl)-2-propan-2-yl-1,2,3,6-tetrahydropyridine
CID 10866958

Frequently Asked Questions

What is the IUPAC name of 4-methyl-N-propan-2-ylpent-2-en-1-amine?
The IUPAC name of 4-methyl-N-propan-2-ylpent-2-en-1-amine (CID 79347587) is 4-methyl-N-propan-2-ylpent-2-en-1-amine.
What is the SMILES notation for 4-methyl-N-propan-2-ylpent-2-en-1-amine?
The canonical SMILES for 4-methyl-N-propan-2-ylpent-2-en-1-amine is CC(C)C=CCNC(C)C.
What is the InChIKey of 4-methyl-N-propan-2-ylpent-2-en-1-amine?
The InChIKey is STORPARNRDMIST-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H19N/c1-8(2)6-5-7-10-9(3)4/h5-6,8-10H,7H2,1-4H3.
What are the key properties of 4-methyl-N-propan-2-ylpent-2-en-1-amine?
4-methyl-N-propan-2-ylpent-2-en-1-amine has a molecular weight of 141.26 g/mol, XLogP of 2.20, 4 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methyl-N-propan-2-ylpent-2-en-1-amine is sourced from PubChem (CID 79347587), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).