4-[(Z)-1-aminoprop-1-enyl]cyclohex-3-en-1-amine

C9H16N2 — CID 70313906

IUPAC4-[(Z)-1-aminoprop-1-enyl]cyclohex-3-en-1-amine
SMILESC/C=C(\N)C1=CCC(N)CC1
InChIInChI=1S/C9H16N2/c1-2-9(11)7-3-5-8(10)6-4-7/h2-3,8H,4-6,10-11H2,1H3/b9-2-
InChIKeyWPWAYQSMTVYFMQ-MBXJOHMKSA-N
MW152.24 g/mol
LogP1.29
Rot. Bonds1

About 4-[(Z)-1-aminoprop-1-enyl]cyclohex-3-en-1-amine

4-[(Z)-1-aminoprop-1-enyl]cyclohex-3-en-1-amine (PubChem CID 70313906) has the molecular formula C9H16N2 and a molecular weight of 152.24 g/mol. Its IUPAC name is 4-[(Z)-1-aminoprop-1-enyl]cyclohex-3-en-1-amine.

Molecular Properties

Compound Name4-[(Z)-1-aminoprop-1-enyl]cyclohex-3-en-1-amine
PubChem CID70313906
Molecular FormulaC9H16N2
Molecular Weight152.24 g/mol
Exact Mass152.13
IUPAC Name4-[(Z)-1-aminoprop-1-enyl]cyclohex-3-en-1-amine
SMILESC/C=C(\N)C1=CCC(N)CC1
InChIInChI=1S/C9H16N2/c1-2-9(11)7-3-5-8(10)6-4-7/h2-3,8H,4-6,10-11H2,1H3/b9-2-
InChIKeyWPWAYQSMTVYFMQ-MBXJOHMKSA-N
XLogP1.29
TPSA52.04 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500152.24
LogP ≤ 51.29
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 4-[(Z)-1-aminoprop-1-enyl]cyclohex-3-en-1-amine?
The IUPAC name of 4-[(Z)-1-aminoprop-1-enyl]cyclohex-3-en-1-amine (CID 70313906) is 4-[(Z)-1-aminoprop-1-enyl]cyclohex-3-en-1-amine.
What is the SMILES notation for 4-[(Z)-1-aminoprop-1-enyl]cyclohex-3-en-1-amine?
The canonical SMILES for 4-[(Z)-1-aminoprop-1-enyl]cyclohex-3-en-1-amine is C/C=C(\N)C1=CCC(N)CC1.
What is the InChIKey of 4-[(Z)-1-aminoprop-1-enyl]cyclohex-3-en-1-amine?
The InChIKey is WPWAYQSMTVYFMQ-MBXJOHMKSA-N. The full InChI is InChI=1S/C9H16N2/c1-2-9(11)7-3-5-8(10)6-4-7/h2-3,8H,4-6,10-11H2,1H3/b9-2-.
What are the key properties of 4-[(Z)-1-aminoprop-1-enyl]cyclohex-3-en-1-amine?
4-[(Z)-1-aminoprop-1-enyl]cyclohex-3-en-1-amine has a molecular weight of 152.24 g/mol, XLogP of 1.29, 1 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[(Z)-1-aminoprop-1-enyl]cyclohex-3-en-1-amine is sourced from PubChem (CID 70313906), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).