2-methyl-1-(1-methyl-3-propylcyclopent-3-en-1-yl)prop-2-en-1-amine

C13H23N — CID 134527332

IUPAC2-methyl-1-(1-methyl-3-propylcyclopent-3-en-1-yl)prop-2-en-1-amine
SMILESC=C(C)C(N)C1(C)CC=C(CCC)C1
InChIInChI=1S/C13H23N/c1-5-6-11-7-8-13(4,9-11)12(14)10(2)3/h7,12H,2,5-6,8-9,14H2,1,3-4H3
InChIKeyGADJYPWJGFSBTM-UHFFFAOYSA-N
MW193.33 g/mol
LogP3.42
Rot. Bonds4

About 2-methyl-1-(1-methyl-3-propylcyclopent-3-en-1-yl)prop-2-en-1-amine

2-methyl-1-(1-methyl-3-propylcyclopent-3-en-1-yl)prop-2-en-1-amine (PubChem CID 134527332) has the molecular formula C13H23N and a molecular weight of 193.33 g/mol. Its IUPAC name is 2-methyl-1-(1-methyl-3-propylcyclopent-3-en-1-yl)prop-2-en-1-amine.

Molecular Properties

Compound Name2-methyl-1-(1-methyl-3-propylcyclopent-3-en-1-yl)prop-2-en-1-amine
PubChem CID134527332
Molecular FormulaC13H23N
Molecular Weight193.33 g/mol
Exact Mass193.18
IUPAC Name2-methyl-1-(1-methyl-3-propylcyclopent-3-en-1-yl)prop-2-en-1-amine
SMILESC=C(C)C(N)C1(C)CC=C(CCC)C1
InChIInChI=1S/C13H23N/c1-5-6-11-7-8-13(4,9-11)12(14)10(2)3/h7,12H,2,5-6,8-9,14H2,1,3-4H3
InChIKeyGADJYPWJGFSBTM-UHFFFAOYSA-N
XLogP3.42
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500193.33
LogP ≤ 53.42
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

1,3-dipropylcyclohex-3-en-1-ol
CID 101312174
1,4-dipropylcyclopenta-1,3-diene
CID 19391248
(1S)-5-methyl-1-(1-methylcyclopropyl)-2-propylhex-5-en-1-amine
CID 126581092
[2-methyl-1-(4-propylthiadiazol-5-yl)prop-2-enyl]hydrazine
CID 105320041
1-ethyl-4-propylcyclopenta-1,3-diene
CID 139667468
4,4-dimethyl-1-(4-methylpent-3-enyl)cyclohexene
CID 143132171
3-ethyl-N,N,1-trimethylcyclopent-3-en-1-amine
CID 167291278
1-(2,2-dimethylcyclopropyl)-2-methyl-N-propylprop-2-en-1-amine
CID 107004692
(1R)-1-(4-ethylphenyl)-3-methylbut-3-en-1-amine
CID 171211237
1-methyl-4-propylcyclopenta-1,3-diene
CID 18798459
1-(4-propylphenyl)cyclopropan-1-amine
CID 82280519
(4aR,8aS)-6-(4-methylpent-3-enyl)-1,2,3,4,5,8-hexahydronaphthalene-4a,8a-diol
CID 102105202

Frequently Asked Questions

What is the IUPAC name of 2-methyl-1-(1-methyl-3-propylcyclopent-3-en-1-yl)prop-2-en-1-amine?
The IUPAC name of 2-methyl-1-(1-methyl-3-propylcyclopent-3-en-1-yl)prop-2-en-1-amine (CID 134527332) is 2-methyl-1-(1-methyl-3-propylcyclopent-3-en-1-yl)prop-2-en-1-amine.
What is the SMILES notation for 2-methyl-1-(1-methyl-3-propylcyclopent-3-en-1-yl)prop-2-en-1-amine?
The canonical SMILES for 2-methyl-1-(1-methyl-3-propylcyclopent-3-en-1-yl)prop-2-en-1-amine is C=C(C)C(N)C1(C)CC=C(CCC)C1.
What is the InChIKey of 2-methyl-1-(1-methyl-3-propylcyclopent-3-en-1-yl)prop-2-en-1-amine?
The InChIKey is GADJYPWJGFSBTM-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H23N/c1-5-6-11-7-8-13(4,9-11)12(14)10(2)3/h7,12H,2,5-6,8-9,14H2,1,3-4H3.
What are the key properties of 2-methyl-1-(1-methyl-3-propylcyclopent-3-en-1-yl)prop-2-en-1-amine?
2-methyl-1-(1-methyl-3-propylcyclopent-3-en-1-yl)prop-2-en-1-amine has a molecular weight of 193.33 g/mol, XLogP of 3.42, 4 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-1-(1-methyl-3-propylcyclopent-3-en-1-yl)prop-2-en-1-amine is sourced from PubChem (CID 134527332), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).