N-[(Z)-4-methylpent-2-en-3-yl]-2-propan-2-ylcyclopentan-1-imine

C14H25N — CID 175621522

IUPACN-[(Z)-4-methylpent-2-en-3-yl]-2-propan-2-ylcyclopentan-1-imine
SMILESC/C=C(\N=C1/CCCC1C(C)C)C(C)C
InChIInChI=1S/C14H25N/c1-6-13(11(4)5)15-14-9-7-8-12(14)10(2)3/h6,10-12H,7-9H2,1-5H3/b13-6-,15-14+
InChIKeyKGXCAKPKKDCDRE-IAWNYDFXSA-N
MW207.36 g/mol
LogP4.44
Rot. Bonds3

About N-[(Z)-4-methylpent-2-en-3-yl]-2-propan-2-ylcyclopentan-1-imine

N-[(Z)-4-methylpent-2-en-3-yl]-2-propan-2-ylcyclopentan-1-imine (PubChem CID 175621522) has the molecular formula C14H25N and a molecular weight of 207.36 g/mol. Its IUPAC name is N-[(Z)-4-methylpent-2-en-3-yl]-2-propan-2-ylcyclopentan-1-imine.

Molecular Properties

Compound NameN-[(Z)-4-methylpent-2-en-3-yl]-2-propan-2-ylcyclopentan-1-imine
PubChem CID175621522
Molecular FormulaC14H25N
Molecular Weight207.36 g/mol
Exact Mass207.20
IUPAC NameN-[(Z)-4-methylpent-2-en-3-yl]-2-propan-2-ylcyclopentan-1-imine
SMILESC/C=C(\N=C1/CCCC1C(C)C)C(C)C
InChIInChI=1S/C14H25N/c1-6-13(11(4)5)15-14-9-7-8-12(14)10(2)3/h6,10-12H,7-9H2,1-5H3/b13-6-,15-14+
InChIKeyKGXCAKPKKDCDRE-IAWNYDFXSA-N
XLogP4.44
TPSA12.36 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500207.36
LogP ≤ 54.44
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of N-[(Z)-4-methylpent-2-en-3-yl]-2-propan-2-ylcyclopentan-1-imine?
The IUPAC name of N-[(Z)-4-methylpent-2-en-3-yl]-2-propan-2-ylcyclopentan-1-imine (CID 175621522) is N-[(Z)-4-methylpent-2-en-3-yl]-2-propan-2-ylcyclopentan-1-imine.
What is the SMILES notation for N-[(Z)-4-methylpent-2-en-3-yl]-2-propan-2-ylcyclopentan-1-imine?
The canonical SMILES for N-[(Z)-4-methylpent-2-en-3-yl]-2-propan-2-ylcyclopentan-1-imine is C/C=C(\N=C1/CCCC1C(C)C)C(C)C.
What is the InChIKey of N-[(Z)-4-methylpent-2-en-3-yl]-2-propan-2-ylcyclopentan-1-imine?
The InChIKey is KGXCAKPKKDCDRE-IAWNYDFXSA-N. The full InChI is InChI=1S/C14H25N/c1-6-13(11(4)5)15-14-9-7-8-12(14)10(2)3/h6,10-12H,7-9H2,1-5H3/b13-6-,15-14+.
What are the key properties of N-[(Z)-4-methylpent-2-en-3-yl]-2-propan-2-ylcyclopentan-1-imine?
N-[(Z)-4-methylpent-2-en-3-yl]-2-propan-2-ylcyclopentan-1-imine has a molecular weight of 207.36 g/mol, XLogP of 4.44, 3 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(Z)-4-methylpent-2-en-3-yl]-2-propan-2-ylcyclopentan-1-imine is sourced from PubChem (CID 175621522), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).