3-[(1-cyclopropylpropan-2-ylamino)methyl]cyclopentan-1-ol

C12H23NO — CID 103271439

IUPAC3-[(1-cyclopropylpropan-2-ylamino)methyl]cyclopentan-1-ol
SMILESCC(CC1CC1)NCC1CCC(O)C1
InChIInChI=1S/C12H23NO/c1-9(6-10-2-3-10)13-8-11-4-5-12(14)7-11/h9-14H,2-8H2,1H3
InChIKeyWRKJMTMAGKPWIS-UHFFFAOYSA-N
MW197.32 g/mol
LogP1.93
Rot. Bonds5

About 3-[(1-cyclopropylpropan-2-ylamino)methyl]cyclopentan-1-ol

3-[(1-cyclopropylpropan-2-ylamino)methyl]cyclopentan-1-ol (PubChem CID 103271439) has the molecular formula C12H23NO and a molecular weight of 197.32 g/mol. Its IUPAC name is 3-[(1-cyclopropylpropan-2-ylamino)methyl]cyclopentan-1-ol.

Molecular Properties

Compound Name3-[(1-cyclopropylpropan-2-ylamino)methyl]cyclopentan-1-ol
PubChem CID103271439
Molecular FormulaC12H23NO
Molecular Weight197.32 g/mol
Exact Mass197.18
IUPAC Name3-[(1-cyclopropylpropan-2-ylamino)methyl]cyclopentan-1-ol
SMILESCC(CC1CC1)NCC1CCC(O)C1
InChIInChI=1S/C12H23NO/c1-9(6-10-2-3-10)13-8-11-4-5-12(14)7-11/h9-14H,2-8H2,1H3
InChIKeyWRKJMTMAGKPWIS-UHFFFAOYSA-N
XLogP1.93
TPSA32.26 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500197.32
LogP ≤ 51.93
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

3-[(pentan-2-ylamino)methyl]cyclopentan-1-ol
CID 103271338
3-[(but-3-yn-2-ylamino)methyl]cyclopentan-1-ol
CID 106129449
3-[(1-ethoxypropan-2-ylamino)methyl]cyclopentan-1-ol
CID 103271450
3-[[(4-methoxy-4-methylpentan-2-yl)amino]methyl]cyclopentan-1-ol
CID 103271409
3-[(pentan-3-ylamino)methyl]cyclopentan-1-ol
CID 103271506
3-[(1,1-dimethoxypropan-2-ylamino)methyl]cyclopentan-1-ol
CID 106121090
N-carbamoyl-2-[(3-hydroxycyclopentyl)methylamino]propanamide
CID 106129954
3-[(2-methylpropylamino)methyl]cyclopentan-1-ol
CID 103270977
N-tert-butyl-2-[(3-hydroxycyclopentyl)methylamino]propanamide
CID 114147359
3-[(1-piperidin-2-ylpropan-2-ylamino)methyl]cyclohexan-1-ol
CID 114146569
4-[(4-methylpentan-2-ylamino)methyl]cyclohexan-1-ol
CID 106126383
3-[(6-methylhept-5-en-2-ylamino)methyl]cyclohexan-1-ol
CID 75428345

Frequently Asked Questions

What is the IUPAC name of 3-[(1-cyclopropylpropan-2-ylamino)methyl]cyclopentan-1-ol?
The IUPAC name of 3-[(1-cyclopropylpropan-2-ylamino)methyl]cyclopentan-1-ol (CID 103271439) is 3-[(1-cyclopropylpropan-2-ylamino)methyl]cyclopentan-1-ol.
What is the SMILES notation for 3-[(1-cyclopropylpropan-2-ylamino)methyl]cyclopentan-1-ol?
The canonical SMILES for 3-[(1-cyclopropylpropan-2-ylamino)methyl]cyclopentan-1-ol is CC(CC1CC1)NCC1CCC(O)C1.
What is the InChIKey of 3-[(1-cyclopropylpropan-2-ylamino)methyl]cyclopentan-1-ol?
The InChIKey is WRKJMTMAGKPWIS-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H23NO/c1-9(6-10-2-3-10)13-8-11-4-5-12(14)7-11/h9-14H,2-8H2,1H3.
What are the key properties of 3-[(1-cyclopropylpropan-2-ylamino)methyl]cyclopentan-1-ol?
3-[(1-cyclopropylpropan-2-ylamino)methyl]cyclopentan-1-ol has a molecular weight of 197.32 g/mol, XLogP of 1.93, 5 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[(1-cyclopropylpropan-2-ylamino)methyl]cyclopentan-1-ol is sourced from PubChem (CID 103271439), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).