4-(cyclopentylmethyl)-1-methylpyrrolidin-3-ol

C11H21NO — CID 145293090

IUPAC4-(cyclopentylmethyl)-1-methylpyrrolidin-3-ol
SMILESCN1CC(O)C(CC2CCCC2)C1
InChIInChI=1S/C11H21NO/c1-12-7-10(11(13)8-12)6-9-4-2-3-5-9/h9-11,13H,2-8H2,1H3
InChIKeyMCEZOEXQTOJRPN-UHFFFAOYSA-N
MW183.29 g/mol
LogP1.49
Rot. Bonds2

About 4-(cyclopentylmethyl)-1-methylpyrrolidin-3-ol

4-(cyclopentylmethyl)-1-methylpyrrolidin-3-ol (PubChem CID 145293090) has the molecular formula C11H21NO and a molecular weight of 183.29 g/mol. Its IUPAC name is 4-(cyclopentylmethyl)-1-methylpyrrolidin-3-ol.

Molecular Properties

Compound Name4-(cyclopentylmethyl)-1-methylpyrrolidin-3-ol
PubChem CID145293090
Molecular FormulaC11H21NO
Molecular Weight183.29 g/mol
Exact Mass183.16
IUPAC Name4-(cyclopentylmethyl)-1-methylpyrrolidin-3-ol
SMILESCN1CC(O)C(CC2CCCC2)C1
InChIInChI=1S/C11H21NO/c1-12-7-10(11(13)8-12)6-9-4-2-3-5-9/h9-11,13H,2-8H2,1H3
InChIKeyMCEZOEXQTOJRPN-UHFFFAOYSA-N
XLogP1.49
TPSA23.47 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500183.29
LogP ≤ 51.49
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1-methyl-3-(piperidin-4-ylmethyl)piperidin-4-ol
CID 119054544
(3R,4R)-4-(methoxymethyl)-1-methylpyrrolidin-3-ol
CID 140507745
(4S)-4-ethyl-1-methylpiperidin-3-ol
CID 142979946
3-(cyclopentylmethyl)-2-methylcyclopentan-1-ol
CID 64910317
(3S,4R)-4-(iodomethyl)-1-methylpiperidin-3-ol
CID 89166355
4-butyl-1-methylpyrrolidin-3-ol
CID 140584543
1-(2-aminoethyl)-3-(cyclopropylmethyl)piperidin-4-ol
CID 121203017
(3S,4R)-4-(ethylsulfanylmethyl)-1-methylpyrrolidin-3-ol
CID 140545349
1-methylazepan-3-ol
CID 22636113
(4R)-3-(hydroxymethyl)-1-methylpiperidin-4-ol
CID 142983672
(3R,4R,5R)-5-(hydroxymethyl)-1-methylpiperidine-3,4-diol;hydrochloride
CID 172714934
(3R,4S)-1-(3-aminopropyl)-3-(cyclopropylmethyl)piperidin-4-ol
CID 129497955

Frequently Asked Questions

What is the IUPAC name of 4-(cyclopentylmethyl)-1-methylpyrrolidin-3-ol?
The IUPAC name of 4-(cyclopentylmethyl)-1-methylpyrrolidin-3-ol (CID 145293090) is 4-(cyclopentylmethyl)-1-methylpyrrolidin-3-ol.
What is the SMILES notation for 4-(cyclopentylmethyl)-1-methylpyrrolidin-3-ol?
The canonical SMILES for 4-(cyclopentylmethyl)-1-methylpyrrolidin-3-ol is CN1CC(O)C(CC2CCCC2)C1.
What is the InChIKey of 4-(cyclopentylmethyl)-1-methylpyrrolidin-3-ol?
The InChIKey is MCEZOEXQTOJRPN-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H21NO/c1-12-7-10(11(13)8-12)6-9-4-2-3-5-9/h9-11,13H,2-8H2,1H3.
What are the key properties of 4-(cyclopentylmethyl)-1-methylpyrrolidin-3-ol?
4-(cyclopentylmethyl)-1-methylpyrrolidin-3-ol has a molecular weight of 183.29 g/mol, XLogP of 1.49, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(cyclopentylmethyl)-1-methylpyrrolidin-3-ol is sourced from PubChem (CID 145293090), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).