[1-(1-propylpiperidin-4-yl)pyrrolidin-3-yl]methanol

C13H26N2O — CID 64866043

IUPAC[1-(1-propylpiperidin-4-yl)pyrrolidin-3-yl]methanol
SMILESCCCN1CCC(N2CCC(CO)C2)CC1
InChIInChI=1S/C13H26N2O/c1-2-6-14-7-4-13(5-8-14)15-9-3-12(10-15)11-16/h12-13,16H,2-11H2,1H3
InChIKeyKHYABQRXWPQIFY-UHFFFAOYSA-N
MW226.36 g/mol
LogP1.17
Rot. Bonds4

About [1-(1-propylpiperidin-4-yl)pyrrolidin-3-yl]methanol

[1-(1-propylpiperidin-4-yl)pyrrolidin-3-yl]methanol (PubChem CID 64866043) has the molecular formula C13H26N2O and a molecular weight of 226.36 g/mol. Its IUPAC name is [1-(1-propylpiperidin-4-yl)pyrrolidin-3-yl]methanol.

Molecular Properties

Compound Name[1-(1-propylpiperidin-4-yl)pyrrolidin-3-yl]methanol
PubChem CID64866043
Molecular FormulaC13H26N2O
Molecular Weight226.36 g/mol
Exact Mass226.20
IUPAC Name[1-(1-propylpiperidin-4-yl)pyrrolidin-3-yl]methanol
SMILESCCCN1CCC(N2CCC(CO)C2)CC1
InChIInChI=1S/C13H26N2O/c1-2-6-14-7-4-13(5-8-14)15-9-3-12(10-15)11-16/h12-13,16H,2-11H2,1H3
InChIKeyKHYABQRXWPQIFY-UHFFFAOYSA-N
XLogP1.17
TPSA26.71 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500226.36
LogP ≤ 51.17
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

[1-(1-ethylpyrrolidin-3-yl)pyrrolidin-3-yl]methanol
CID 117005885
4-(3-methylpyrrolidin-1-yl)-1-[(1-propylpiperidin-4-yl)methyl]piperidine
CID 170063897
[1-[1-(3-methylbutyl)pyrrolidin-3-yl]pyrrolidin-3-yl]methanol
CID 117005906
2-[1-(1-propylpiperidin-4-yl)azetidin-3-yl]acetic acid
CID 65069382
N-[(1-cyclopropylpyrrolidin-3-yl)methyl]-1-propylazepan-4-amine
CID 65073267
[1-(1-methylpiperidin-4-yl)piperidin-4-yl]methanol
CID 83835284
1-propyl-4-[(1-propylpiperidin-4-yl)methyl]piperidine
CID 172611487
(3S)-1-(1-propylpiperidin-4-yl)piperidine-3-carboxamide
CID 30982597
ethane;1-[1-[1-(1-propylpiperidin-4-yl)piperidin-4-yl]piperidin-4-yl]ethanone
CID 169158837
[1-(2,2-diethyloxan-4-yl)pyrrolidin-3-yl]methanol
CID 83040396
[(3S)-1-(4-ethylcyclohexyl)piperidin-3-yl]methanol
CID 40506920
2-[4-[3-(aminomethyl)pyrrolidin-1-yl]piperidin-1-yl]-N,N-dimethylethanamine
CID 117005638

Frequently Asked Questions

What is the IUPAC name of [1-(1-propylpiperidin-4-yl)pyrrolidin-3-yl]methanol?
The IUPAC name of [1-(1-propylpiperidin-4-yl)pyrrolidin-3-yl]methanol (CID 64866043) is [1-(1-propylpiperidin-4-yl)pyrrolidin-3-yl]methanol.
What is the SMILES notation for [1-(1-propylpiperidin-4-yl)pyrrolidin-3-yl]methanol?
The canonical SMILES for [1-(1-propylpiperidin-4-yl)pyrrolidin-3-yl]methanol is CCCN1CCC(N2CCC(CO)C2)CC1.
What is the InChIKey of [1-(1-propylpiperidin-4-yl)pyrrolidin-3-yl]methanol?
The InChIKey is KHYABQRXWPQIFY-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H26N2O/c1-2-6-14-7-4-13(5-8-14)15-9-3-12(10-15)11-16/h12-13,16H,2-11H2,1H3.
What are the key properties of [1-(1-propylpiperidin-4-yl)pyrrolidin-3-yl]methanol?
[1-(1-propylpiperidin-4-yl)pyrrolidin-3-yl]methanol has a molecular weight of 226.36 g/mol, XLogP of 1.17, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [1-(1-propylpiperidin-4-yl)pyrrolidin-3-yl]methanol is sourced from PubChem (CID 64866043), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).