[1-[(hex-5-en-2-ylamino)methyl]cyclopropyl]methanol

C11H21NO — CID 104582881

IUPAC[1-[(hex-5-en-2-ylamino)methyl]cyclopropyl]methanol
SMILESC=CCCC(C)NCC1(CO)CC1
InChIInChI=1S/C11H21NO/c1-3-4-5-10(2)12-8-11(9-13)6-7-11/h3,10,12-13H,1,4-9H2,2H3
InChIKeyYWXDTYXOTRNRBD-UHFFFAOYSA-N
MW183.29 g/mol
LogP1.70
Rot. Bonds7

About [1-[(hex-5-en-2-ylamino)methyl]cyclopropyl]methanol

[1-[(hex-5-en-2-ylamino)methyl]cyclopropyl]methanol (PubChem CID 104582881) has the molecular formula C11H21NO and a molecular weight of 183.29 g/mol. Its IUPAC name is [1-[(hex-5-en-2-ylamino)methyl]cyclopropyl]methanol.

Molecular Properties

Compound Name[1-[(hex-5-en-2-ylamino)methyl]cyclopropyl]methanol
PubChem CID104582881
Molecular FormulaC11H21NO
Molecular Weight183.29 g/mol
Exact Mass183.16
IUPAC Name[1-[(hex-5-en-2-ylamino)methyl]cyclopropyl]methanol
SMILESC=CCCC(C)NCC1(CO)CC1
InChIInChI=1S/C11H21NO/c1-3-4-5-10(2)12-8-11(9-13)6-7-11/h3,10,12-13H,1,4-9H2,2H3
InChIKeyYWXDTYXOTRNRBD-UHFFFAOYSA-N
XLogP1.70
TPSA32.26 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500183.29
LogP ≤ 51.70
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

Analyze [1-[(hex-5-en-2-ylamino)methyl]cyclopropyl]methanol with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of [1-[(hex-5-en-2-ylamino)methyl]cyclopropyl]methanol?
The IUPAC name of [1-[(hex-5-en-2-ylamino)methyl]cyclopropyl]methanol (CID 104582881) is [1-[(hex-5-en-2-ylamino)methyl]cyclopropyl]methanol.
What is the SMILES notation for [1-[(hex-5-en-2-ylamino)methyl]cyclopropyl]methanol?
The canonical SMILES for [1-[(hex-5-en-2-ylamino)methyl]cyclopropyl]methanol is C=CCCC(C)NCC1(CO)CC1.
What is the InChIKey of [1-[(hex-5-en-2-ylamino)methyl]cyclopropyl]methanol?
The InChIKey is YWXDTYXOTRNRBD-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H21NO/c1-3-4-5-10(2)12-8-11(9-13)6-7-11/h3,10,12-13H,1,4-9H2,2H3.
What are the key properties of [1-[(hex-5-en-2-ylamino)methyl]cyclopropyl]methanol?
[1-[(hex-5-en-2-ylamino)methyl]cyclopropyl]methanol has a molecular weight of 183.29 g/mol, XLogP of 1.70, 7 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [1-[(hex-5-en-2-ylamino)methyl]cyclopropyl]methanol is sourced from PubChem (CID 104582881), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).