[1-(prop-2-enylamino)cyclopentyl]methanol

C9H17NO — CID 62517760

IUPAC[1-(prop-2-enylamino)cyclopentyl]methanol
SMILESC=CCNC1(CO)CCCC1
InChIInChI=1S/C9H17NO/c1-2-7-10-9(8-11)5-3-4-6-9/h2,10-11H,1,3-8H2
InChIKeyULVCUUITBKCDFJ-UHFFFAOYSA-N
MW155.24 g/mol
LogP1.07
Rot. Bonds4

About [1-(prop-2-enylamino)cyclopentyl]methanol

[1-(prop-2-enylamino)cyclopentyl]methanol (PubChem CID 62517760) has the molecular formula C9H17NO and a molecular weight of 155.24 g/mol. Its IUPAC name is [1-(prop-2-enylamino)cyclopentyl]methanol.

Molecular Properties

Compound Name[1-(prop-2-enylamino)cyclopentyl]methanol
PubChem CID62517760
Molecular FormulaC9H17NO
Molecular Weight155.24 g/mol
Exact Mass155.13
IUPAC Name[1-(prop-2-enylamino)cyclopentyl]methanol
SMILESC=CCNC1(CO)CCCC1
InChIInChI=1S/C9H17NO/c1-2-7-10-9(8-11)5-3-4-6-9/h2,10-11H,1,3-8H2
InChIKeyULVCUUITBKCDFJ-UHFFFAOYSA-N
XLogP1.07
TPSA32.26 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500155.24
LogP ≤ 51.07
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of [1-(prop-2-enylamino)cyclopentyl]methanol?
The IUPAC name of [1-(prop-2-enylamino)cyclopentyl]methanol (CID 62517760) is [1-(prop-2-enylamino)cyclopentyl]methanol.
What is the SMILES notation for [1-(prop-2-enylamino)cyclopentyl]methanol?
The canonical SMILES for [1-(prop-2-enylamino)cyclopentyl]methanol is C=CCNC1(CO)CCCC1.
What is the InChIKey of [1-(prop-2-enylamino)cyclopentyl]methanol?
The InChIKey is ULVCUUITBKCDFJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H17NO/c1-2-7-10-9(8-11)5-3-4-6-9/h2,10-11H,1,3-8H2.
What are the key properties of [1-(prop-2-enylamino)cyclopentyl]methanol?
[1-(prop-2-enylamino)cyclopentyl]methanol has a molecular weight of 155.24 g/mol, XLogP of 1.07, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [1-(prop-2-enylamino)cyclopentyl]methanol is sourced from PubChem (CID 62517760), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).