1-[2-(6-methylhept-5-en-2-ylamino)ethyl]cyclopentan-1-ol

C15H29NO — CID 56859408

IUPAC1-[2-(6-methylhept-5-en-2-ylamino)ethyl]cyclopentan-1-ol
SMILESCC(C)=CCCC(C)NCCC1(O)CCCC1
InChIInChI=1S/C15H29NO/c1-13(2)7-6-8-14(3)16-12-11-15(17)9-4-5-10-15/h7,14,16-17H,4-6,8-12H2,1-3H3
InChIKeyQSWWGXASCUQRGF-UHFFFAOYSA-N
MW239.40 g/mol
LogP3.41
Rot. Bonds7

About 1-[2-(6-methylhept-5-en-2-ylamino)ethyl]cyclopentan-1-ol

1-[2-(6-methylhept-5-en-2-ylamino)ethyl]cyclopentan-1-ol (PubChem CID 56859408) has the molecular formula C15H29NO and a molecular weight of 239.40 g/mol. Its IUPAC name is 1-[2-(6-methylhept-5-en-2-ylamino)ethyl]cyclopentan-1-ol.

Molecular Properties

Compound Name1-[2-(6-methylhept-5-en-2-ylamino)ethyl]cyclopentan-1-ol
PubChem CID56859408
Molecular FormulaC15H29NO
Molecular Weight239.40 g/mol
Exact Mass239.22
IUPAC Name1-[2-(6-methylhept-5-en-2-ylamino)ethyl]cyclopentan-1-ol
SMILESCC(C)=CCCC(C)NCCC1(O)CCCC1
InChIInChI=1S/C15H29NO/c1-13(2)7-6-8-14(3)16-12-11-15(17)9-4-5-10-15/h7,14,16-17H,4-6,8-12H2,1-3H3
InChIKeyQSWWGXASCUQRGF-UHFFFAOYSA-N
XLogP3.41
TPSA32.26 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500239.40
LogP ≤ 53.41
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

3,5,7-Trimethyl-2-(propan-2-ylamino)oct-5-en-2-ol
CID 123448730
1-(2-{[(2E)-3,7-dimethyl-2,6-octadien-1-yl]amino}ethyl)cyclopentanol
CID 39746149
1-[[2-(Cyclohexen-1-yl)ethylamino]methyl]cyclopentan-1-ol
CID 65211211
1-[(Cyclohex-3-en-1-ylamino)methyl]cyclopentan-1-ol
CID 65701300
1-[2-(3,7-Dimethylocta-2,6-dienylamino)ethyl]cyclopentan-1-ol
CID 72083784
1-[(Hept-6-en-3-ylamino)methyl]cyclopentan-1-ol
CID 75428093
1-[[[(3S)-hept-6-en-3-yl]amino]methyl]cyclopentan-1-ol
CID 97322404
1-[[[(3R)-hept-6-en-3-yl]amino]methyl]cyclopentan-1-ol
CID 97322405
3-[(3,5-Dimethylcyclohex-3-en-1-yl)methylamino]pentan-1-ol
CID 103277112
1-[(Hex-5-en-2-ylamino)methyl]cyclopentan-1-ol
CID 104582440
3-[2-(Cyclopenten-1-yl)ethylamino]-2-methylbutan-2-ol
CID 106168940
4-[2-(Cyclopenten-1-yl)ethylamino]-2-methylbutan-2-ol
CID 106173928

Frequently Asked Questions

What is the IUPAC name of 1-[2-(6-methylhept-5-en-2-ylamino)ethyl]cyclopentan-1-ol?
The IUPAC name of 1-[2-(6-methylhept-5-en-2-ylamino)ethyl]cyclopentan-1-ol (CID 56859408) is 1-[2-(6-methylhept-5-en-2-ylamino)ethyl]cyclopentan-1-ol.
What is the SMILES notation for 1-[2-(6-methylhept-5-en-2-ylamino)ethyl]cyclopentan-1-ol?
The canonical SMILES for 1-[2-(6-methylhept-5-en-2-ylamino)ethyl]cyclopentan-1-ol is CC(C)=CCCC(C)NCCC1(O)CCCC1.
What is the InChIKey of 1-[2-(6-methylhept-5-en-2-ylamino)ethyl]cyclopentan-1-ol?
The InChIKey is QSWWGXASCUQRGF-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H29NO/c1-13(2)7-6-8-14(3)16-12-11-15(17)9-4-5-10-15/h7,14,16-17H,4-6,8-12H2,1-3H3.
What are the key properties of 1-[2-(6-methylhept-5-en-2-ylamino)ethyl]cyclopentan-1-ol?
1-[2-(6-methylhept-5-en-2-ylamino)ethyl]cyclopentan-1-ol has a molecular weight of 239.40 g/mol, XLogP of 3.41, 7 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[2-(6-methylhept-5-en-2-ylamino)ethyl]cyclopentan-1-ol is sourced from PubChem (CID 56859408), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).