1-[(prop-2-ynylamino)methyl]cyclopentan-1-ol

C9H15NO — CID 65105370

IUPAC1-[(prop-2-ynylamino)methyl]cyclopentan-1-ol
SMILESC#CCNCC1(O)CCCC1
InChIInChI=1S/C9H15NO/c1-2-7-10-8-9(11)5-3-4-6-9/h1,10-11H,3-8H2
InChIKeyULAJWPRAEKXJEZ-UHFFFAOYSA-N
MW153.22 g/mol
LogP0.51
Rot. Bonds3

About 1-[(prop-2-ynylamino)methyl]cyclopentan-1-ol

1-[(prop-2-ynylamino)methyl]cyclopentan-1-ol (PubChem CID 65105370) has the molecular formula C9H15NO and a molecular weight of 153.22 g/mol. Its IUPAC name is 1-[(prop-2-ynylamino)methyl]cyclopentan-1-ol.

Molecular Properties

Compound Name1-[(prop-2-ynylamino)methyl]cyclopentan-1-ol
PubChem CID65105370
Molecular FormulaC9H15NO
Molecular Weight153.22 g/mol
Exact Mass153.12
IUPAC Name1-[(prop-2-ynylamino)methyl]cyclopentan-1-ol
SMILESC#CCNCC1(O)CCCC1
InChIInChI=1S/C9H15NO/c1-2-7-10-8-9(11)5-3-4-6-9/h1,10-11H,3-8H2
InChIKeyULAJWPRAEKXJEZ-UHFFFAOYSA-N
XLogP0.51
TPSA32.26 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500153.22
LogP ≤ 50.51
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

Analyze 1-[(prop-2-ynylamino)methyl]cyclopentan-1-ol with MolForge

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

Launch Full Analysis

Related Compounds

1-[(pent-4-ynylamino)methyl]cyclohexan-1-ol
CID 115664087
1-[[(1-methylcyclopentyl)methylamino]methyl]cyclopentan-1-ol
CID 65211055
N'-[(1-hydroxycycloheptyl)methyl]-N-prop-2-ynylpropanediamide
CID 110017495
1-prop-2-ynylcyclobutan-1-ol
CID 22129000
N-[(1-piperidin-1-ylcyclohexyl)methyl]prop-2-yn-1-amine
CID 60692485
CID 159549662
CID 159549662
1-prop-2-ynylcyclododecan-1-ol
CID 134093446
1-[[2-(dimethylamino)ethylamino]methyl]cyclopentan-1-ol
CID 65109208
1-[(2-methoxyethylamino)methyl]cyclopentan-1-ol
CID 62773566
1-[(dodecylamino)methyl]cyclopentan-1-ol
CID 65108837
1-[(2,3-dimethylbutylamino)methyl]cycloheptan-1-ol
CID 64568933
1-[[(1-propan-2-ylcyclopropyl)methylamino]methyl]cycloheptan-1-ol
CID 114113614

Frequently Asked Questions

What is the IUPAC name of 1-[(prop-2-ynylamino)methyl]cyclopentan-1-ol?
The IUPAC name of 1-[(prop-2-ynylamino)methyl]cyclopentan-1-ol (CID 65105370) is 1-[(prop-2-ynylamino)methyl]cyclopentan-1-ol.
What is the SMILES notation for 1-[(prop-2-ynylamino)methyl]cyclopentan-1-ol?
The canonical SMILES for 1-[(prop-2-ynylamino)methyl]cyclopentan-1-ol is C#CCNCC1(O)CCCC1.
What is the InChIKey of 1-[(prop-2-ynylamino)methyl]cyclopentan-1-ol?
The InChIKey is ULAJWPRAEKXJEZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H15NO/c1-2-7-10-8-9(11)5-3-4-6-9/h1,10-11H,3-8H2.
What are the key properties of 1-[(prop-2-ynylamino)methyl]cyclopentan-1-ol?
1-[(prop-2-ynylamino)methyl]cyclopentan-1-ol has a molecular weight of 153.22 g/mol, XLogP of 0.51, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[(prop-2-ynylamino)methyl]cyclopentan-1-ol is sourced from PubChem (CID 65105370), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).