2-[[cyclopropyl(thiophen-2-ylmethyl)amino]methyl]cyclopentan-1-ol

C14H21NOS — CID 62609943

IUPAC2-[[cyclopropyl(thiophen-2-ylmethyl)amino]methyl]cyclopentan-1-ol
SMILESOC1CCCC1CN(Cc1cccs1)C1CC1
InChIInChI=1S/C14H21NOS/c16-14-5-1-3-11(14)9-15(12-6-7-12)10-13-4-2-8-17-13/h2,4,8,11-12,14,16H,1,3,5-7,9-10H2
InChIKeyNONSYPVFGSLHOM-UHFFFAOYSA-N
MW251.39 g/mol
LogP2.87
Rot. Bonds5

About 2-[[cyclopropyl(thiophen-2-ylmethyl)amino]methyl]cyclopentan-1-ol

2-[[cyclopropyl(thiophen-2-ylmethyl)amino]methyl]cyclopentan-1-ol (PubChem CID 62609943) has the molecular formula C14H21NOS and a molecular weight of 251.39 g/mol. Its IUPAC name is 2-[[cyclopropyl(thiophen-2-ylmethyl)amino]methyl]cyclopentan-1-ol.

Molecular Properties

Compound Name2-[[cyclopropyl(thiophen-2-ylmethyl)amino]methyl]cyclopentan-1-ol
PubChem CID62609943
Molecular FormulaC14H21NOS
Molecular Weight251.39 g/mol
Exact Mass251.13
IUPAC Name2-[[cyclopropyl(thiophen-2-ylmethyl)amino]methyl]cyclopentan-1-ol
SMILESOC1CCCC1CN(Cc1cccs1)C1CC1
InChIInChI=1S/C14H21NOS/c16-14-5-1-3-11(14)9-15(12-6-7-12)10-13-4-2-8-17-13/h2,4,8,11-12,14,16H,1,3,5-7,9-10H2
InChIKeyNONSYPVFGSLHOM-UHFFFAOYSA-N
XLogP2.87
TPSA23.47 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500251.39
LogP ≤ 52.87
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-[[cyclopropyl(thiophen-2-ylmethyl)amino]methyl]-N-methylcycloheptan-1-amine
CID 62610899
2-[cyclopropyl(thiophen-2-ylmethyl)amino]cyclopentan-1-ol
CID 61449195
N-ethyl-N-(thiophen-2-ylmethyl)cyclohexanamine
CID 69253511
1-[cyclopropyl(thiophen-2-ylmethyl)amino]propan-2-one
CID 62029716
(2R)-1-[cyclopropyl(thiophen-2-ylmethyl)amino]propan-2-ol
CID 106932763
N-[[5-(aminomethyl)oxolan-2-yl]methyl]-N-(thiophen-2-ylmethyl)cyclopropanamine
CID 55069477
1-[[cyclopropyl(thiophen-2-ylmethyl)amino]methyl]cyclopentan-1-amine
CID 54948428
4-N-ethyl-4-N-(thiophen-2-ylmethyl)cyclohexane-1,4-diamine
CID 62808156
N-but-3-ynyl-N-(thiophen-2-ylmethyl)cyclopropanamine
CID 63655817
1-cyclopentyl-1-(thiophen-2-ylmethyl)urea;hydrochloride
CID 175237620
N-[[5-(methylaminomethyl)oxolan-2-yl]methyl]-N-(thiophen-2-ylmethyl)cyclopropanamine
CID 62411164
4-[cyclopropyl(thiophen-2-ylmethyl)amino]butanoic acid
CID 61448812

Frequently Asked Questions

What is the IUPAC name of 2-[[cyclopropyl(thiophen-2-ylmethyl)amino]methyl]cyclopentan-1-ol?
The IUPAC name of 2-[[cyclopropyl(thiophen-2-ylmethyl)amino]methyl]cyclopentan-1-ol (CID 62609943) is 2-[[cyclopropyl(thiophen-2-ylmethyl)amino]methyl]cyclopentan-1-ol.
What is the SMILES notation for 2-[[cyclopropyl(thiophen-2-ylmethyl)amino]methyl]cyclopentan-1-ol?
The canonical SMILES for 2-[[cyclopropyl(thiophen-2-ylmethyl)amino]methyl]cyclopentan-1-ol is OC1CCCC1CN(Cc1cccs1)C1CC1.
What is the InChIKey of 2-[[cyclopropyl(thiophen-2-ylmethyl)amino]methyl]cyclopentan-1-ol?
The InChIKey is NONSYPVFGSLHOM-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H21NOS/c16-14-5-1-3-11(14)9-15(12-6-7-12)10-13-4-2-8-17-13/h2,4,8,11-12,14,16H,1,3,5-7,9-10H2.
What are the key properties of 2-[[cyclopropyl(thiophen-2-ylmethyl)amino]methyl]cyclopentan-1-ol?
2-[[cyclopropyl(thiophen-2-ylmethyl)amino]methyl]cyclopentan-1-ol has a molecular weight of 251.39 g/mol, XLogP of 2.87, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[[cyclopropyl(thiophen-2-ylmethyl)amino]methyl]cyclopentan-1-ol is sourced from PubChem (CID 62609943), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).