1,2-dimethyl-2-(prop-2-ynylamino)cyclopentan-1-ol

C10H17NO — CID 130648669

IUPAC1,2-dimethyl-2-(prop-2-ynylamino)cyclopentan-1-ol
SMILESC#CCNC1(C)CCCC1(C)O
InChIInChI=1S/C10H17NO/c1-4-8-11-9(2)6-5-7-10(9,3)12/h1,11-12H,5-8H2,2-3H3
InChIKeyHTPDLCVDQHKSJD-UHFFFAOYSA-N
MW167.25 g/mol
LogP0.90
Rot. Bonds2

About 1,2-dimethyl-2-(prop-2-ynylamino)cyclopentan-1-ol

1,2-dimethyl-2-(prop-2-ynylamino)cyclopentan-1-ol (PubChem CID 130648669) has the molecular formula C10H17NO and a molecular weight of 167.25 g/mol. Its IUPAC name is 1,2-dimethyl-2-(prop-2-ynylamino)cyclopentan-1-ol.

Molecular Properties

Compound Name1,2-dimethyl-2-(prop-2-ynylamino)cyclopentan-1-ol
PubChem CID130648669
Molecular FormulaC10H17NO
Molecular Weight167.25 g/mol
Exact Mass167.13
IUPAC Name1,2-dimethyl-2-(prop-2-ynylamino)cyclopentan-1-ol
SMILESC#CCNC1(C)CCCC1(C)O
InChIInChI=1S/C10H17NO/c1-4-8-11-9(2)6-5-7-10(9,3)12/h1,11-12H,5-8H2,2-3H3
InChIKeyHTPDLCVDQHKSJD-UHFFFAOYSA-N
XLogP0.90
TPSA32.26 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500167.25
LogP ≤ 50.90
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

2-(1,1-Difluoropropan-2-ylamino)-1,2-dimethylcyclopentan-1-ol
CID 130663207
2-[(2,2-Difluoropropyl)amino]-1,2-dimethylcyclopentan-1-ol
CID 164654705
1-[(Tert-butylamino)methyl]-2-methylcyclopentan-1-ol
CID 65049844
2-Methyl-1-[(prop-2-ynylamino)methyl]cyclopentan-1-ol
CID 127002760
2-(But-3-ynylamino)-1-methylcyclopentan-1-ol
CID 130532242
2-(But-2-ynylamino)-1-methylcyclopentan-1-ol
CID 130532261
1,2-Dimethyl-2-(2-methylprop-2-enylamino)cyclopentan-1-ol
CID 130624700
2-[(1-Ethylcyclopropyl)amino]-1,2-dimethylcyclopentan-1-ol
CID 130640663
1,2-Dimethyl-2-[(1-methylcyclopropyl)methylamino]cyclopentan-1-ol
CID 130646174
2-(Diethylamino)-1,2-dimethylcyclopentan-1-ol
CID 130647198
2-(But-3-ynylamino)-1,2-dimethylcyclopentan-1-ol
CID 130657313
1,2-Dimethyl-2-(prop-2-enylamino)cyclopentan-1-ol
CID 130673524

Frequently Asked Questions

What is the IUPAC name of 1,2-dimethyl-2-(prop-2-ynylamino)cyclopentan-1-ol?
The IUPAC name of 1,2-dimethyl-2-(prop-2-ynylamino)cyclopentan-1-ol (CID 130648669) is 1,2-dimethyl-2-(prop-2-ynylamino)cyclopentan-1-ol.
What is the SMILES notation for 1,2-dimethyl-2-(prop-2-ynylamino)cyclopentan-1-ol?
The canonical SMILES for 1,2-dimethyl-2-(prop-2-ynylamino)cyclopentan-1-ol is C#CCNC1(C)CCCC1(C)O.
What is the InChIKey of 1,2-dimethyl-2-(prop-2-ynylamino)cyclopentan-1-ol?
The InChIKey is HTPDLCVDQHKSJD-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H17NO/c1-4-8-11-9(2)6-5-7-10(9,3)12/h1,11-12H,5-8H2,2-3H3.
What are the key properties of 1,2-dimethyl-2-(prop-2-ynylamino)cyclopentan-1-ol?
1,2-dimethyl-2-(prop-2-ynylamino)cyclopentan-1-ol has a molecular weight of 167.25 g/mol, XLogP of 0.90, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1,2-dimethyl-2-(prop-2-ynylamino)cyclopentan-1-ol is sourced from PubChem (CID 130648669), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).