N-(3-methylbut-2-enyl)cyclopent-3-en-1-amine

C10H17N — CID 106547301

IUPACN-(3-methylbut-2-enyl)cyclopent-3-en-1-amine
SMILESCC(C)=CCNC1CC=CC1
InChIInChI=1S/C10H17N/c1-9(2)7-8-11-10-5-3-4-6-10/h3-4,7,10-11H,5-6,8H2,1-2H3
InChIKeySJOSUSPCJZBXEZ-UHFFFAOYSA-N
MW151.25 g/mol
LogP2.26
Rot. Bonds3

About N-(3-methylbut-2-enyl)cyclopent-3-en-1-amine

N-(3-methylbut-2-enyl)cyclopent-3-en-1-amine (PubChem CID 106547301) has the molecular formula C10H17N and a molecular weight of 151.25 g/mol. Its IUPAC name is N-(3-methylbut-2-enyl)cyclopent-3-en-1-amine.

Molecular Properties

Compound NameN-(3-methylbut-2-enyl)cyclopent-3-en-1-amine
PubChem CID106547301
Molecular FormulaC10H17N
Molecular Weight151.25 g/mol
Exact Mass151.14
IUPAC NameN-(3-methylbut-2-enyl)cyclopent-3-en-1-amine
SMILESCC(C)=CCNC1CC=CC1
InChIInChI=1S/C10H17N/c1-9(2)7-8-11-10-5-3-4-6-10/h3-4,7,10-11H,5-6,8H2,1-2H3
InChIKeySJOSUSPCJZBXEZ-UHFFFAOYSA-N
XLogP2.26
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500151.25
LogP ≤ 52.26
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

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CID 22297
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Ethyl-(3,7,11-trimethyl-dodeca-2,6,10-trienyl)-amine
CID 9992270
2,6-Diallyl-4-methyl-1,2,3,6-tetrahydropyridine
CID 2859356
N'-(3,7-dimethylocta-2,6-dienyl)propane-1,3-diamine
CID 123140737
N-[(2E)-3,7-dimethylocta-2,6-dienyl]cyclopropanamine
CID 141815373
Isometheptene-mucate
CID 6604597
1-(Cyclohexa-1,4-dien-1-yl)-N-methylpropan-2-amine
CID 57487843
(2S,6S)-2,6-Diallyl-4-methyl-1,2,3,6-tetrahydropyridine
CID 2063692
6-Methyl-N-(prop-2-en-1-yl)hept-5-en-2-amine
CID 20850

Frequently Asked Questions

What is the IUPAC name of N-(3-methylbut-2-enyl)cyclopent-3-en-1-amine?
The IUPAC name of N-(3-methylbut-2-enyl)cyclopent-3-en-1-amine (CID 106547301) is N-(3-methylbut-2-enyl)cyclopent-3-en-1-amine.
What is the SMILES notation for N-(3-methylbut-2-enyl)cyclopent-3-en-1-amine?
The canonical SMILES for N-(3-methylbut-2-enyl)cyclopent-3-en-1-amine is CC(C)=CCNC1CC=CC1.
What is the InChIKey of N-(3-methylbut-2-enyl)cyclopent-3-en-1-amine?
The InChIKey is SJOSUSPCJZBXEZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H17N/c1-9(2)7-8-11-10-5-3-4-6-10/h3-4,7,10-11H,5-6,8H2,1-2H3.
What are the key properties of N-(3-methylbut-2-enyl)cyclopent-3-en-1-amine?
N-(3-methylbut-2-enyl)cyclopent-3-en-1-amine has a molecular weight of 151.25 g/mol, XLogP of 2.26, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-methylbut-2-enyl)cyclopent-3-en-1-amine is sourced from PubChem (CID 106547301), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).