4-cyclopropylpent-1-en-3-amine

C8H15N — CID 105000971

IUPAC4-cyclopropylpent-1-en-3-amine
SMILESC=CC(N)C(C)C1CC1
InChIInChI=1S/C8H15N/c1-3-8(9)6(2)7-4-5-7/h3,6-8H,1,4-5,9H2,2H3
InChIKeySRPUSBNYNZQZQY-UHFFFAOYSA-N
MW125.21 g/mol
LogP1.55
Rot. Bonds3

About 4-cyclopropylpent-1-en-3-amine

4-cyclopropylpent-1-en-3-amine (PubChem CID 105000971) has the molecular formula C8H15N and a molecular weight of 125.21 g/mol. Its IUPAC name is 4-cyclopropylpent-1-en-3-amine.

Molecular Properties

Compound Name4-cyclopropylpent-1-en-3-amine
PubChem CID105000971
Molecular FormulaC8H15N
Molecular Weight125.21 g/mol
Exact Mass125.12
IUPAC Name4-cyclopropylpent-1-en-3-amine
SMILESC=CC(N)C(C)C1CC1
InChIInChI=1S/C8H15N/c1-3-8(9)6(2)7-4-5-7/h3,6-8H,1,4-5,9H2,2H3
InChIKeySRPUSBNYNZQZQY-UHFFFAOYSA-N
XLogP1.55
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500125.21
LogP ≤ 51.55
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

4-cyclopropyl-N-ethylpent-1-en-3-amine
CID 105000769
1-cyclopropylethanamine
CID 519239
4-(2-methylbut-3-enyl)cyclohexan-1-amine
CID 166976466
(2S,3R)-3-aminopent-4-en-2-ol
CID 131375579
(2S)-but-3-en-2-amine
CID 10034575
2-cyclopropyl-1-(4-methylcyclohexyl)propan-1-amine
CID 104988128
N-but-3-en-2-ylcyclopentanamine
CID 115727919
1-[3-(1-aminoethyl)cyclopentyl]ethanamine
CID 68748757
[(2S)-3-fluorobutan-2-yl]cyclopropane
CID 170226642
(3S)-3-cyclopropylbutan-2-ol
CID 175219475
1-methyl-4-[3-(4-methylcyclohexyl)butan-2-yl]cyclohexane
CID 123821196
4-(4-cyclohexyloxyphenyl)pent-1-en-3-amine
CID 20976404

Frequently Asked Questions

What is the IUPAC name of 4-cyclopropylpent-1-en-3-amine?
The IUPAC name of 4-cyclopropylpent-1-en-3-amine (CID 105000971) is 4-cyclopropylpent-1-en-3-amine.
What is the SMILES notation for 4-cyclopropylpent-1-en-3-amine?
The canonical SMILES for 4-cyclopropylpent-1-en-3-amine is C=CC(N)C(C)C1CC1.
What is the InChIKey of 4-cyclopropylpent-1-en-3-amine?
The InChIKey is SRPUSBNYNZQZQY-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H15N/c1-3-8(9)6(2)7-4-5-7/h3,6-8H,1,4-5,9H2,2H3.
What are the key properties of 4-cyclopropylpent-1-en-3-amine?
4-cyclopropylpent-1-en-3-amine has a molecular weight of 125.21 g/mol, XLogP of 1.55, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 4-cyclopropylpent-1-en-3-amine is sourced from PubChem (CID 105000971), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).