3-[5-(cyclopropylmethylamino)-1-propylpiperidin-3-yl]propan-1-ol

C15H30N2O — CID 83996295

IUPAC3-[5-(cyclopropylmethylamino)-1-propylpiperidin-3-yl]propan-1-ol
SMILESCCCN1CC(CCCO)CC(NCC2CC2)C1
InChIInChI=1S/C15H30N2O/c1-2-7-17-11-14(4-3-8-18)9-15(12-17)16-10-13-5-6-13/h13-16,18H,2-12H2,1H3
InChIKeyBNHZGVLXUHPMQP-UHFFFAOYSA-N
MW254.42 g/mol
LogP1.86
Rot. Bonds8

About 3-[5-(cyclopropylmethylamino)-1-propylpiperidin-3-yl]propan-1-ol

3-[5-(cyclopropylmethylamino)-1-propylpiperidin-3-yl]propan-1-ol (PubChem CID 83996295) has the molecular formula C15H30N2O and a molecular weight of 254.42 g/mol. Its IUPAC name is 3-[5-(cyclopropylmethylamino)-1-propylpiperidin-3-yl]propan-1-ol.

Molecular Properties

Compound Name3-[5-(cyclopropylmethylamino)-1-propylpiperidin-3-yl]propan-1-ol
PubChem CID83996295
Molecular FormulaC15H30N2O
Molecular Weight254.42 g/mol
Exact Mass254.24
IUPAC Name3-[5-(cyclopropylmethylamino)-1-propylpiperidin-3-yl]propan-1-ol
SMILESCCCN1CC(CCCO)CC(NCC2CC2)C1
InChIInChI=1S/C15H30N2O/c1-2-7-17-11-14(4-3-8-18)9-15(12-17)16-10-13-5-6-13/h13-16,18H,2-12H2,1H3
InChIKeyBNHZGVLXUHPMQP-UHFFFAOYSA-N
XLogP1.86
TPSA35.50 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500254.42
LogP ≤ 51.86
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

3-[5-(cyclopropylmethylamino)-1-ethylpiperidin-3-yl]propan-1-ol
CID 83996265
2-[3-(cyclopropylmethylamino)-5-ethylpiperidin-1-yl]ethanol
CID 83996841
3-[5-(cyclopentylmethylamino)-1-propylpiperidin-3-yl]propanoic acid
CID 83997675
3-[1-cyclobutyl-5-(cyclopropylmethylamino)piperidin-3-yl]propan-1-ol
CID 83996650
3-[1-ethyl-5-(ethylamino)piperidin-3-yl]propan-1-ol
CID 83990202
N,1-bis(cyclopropylmethyl)-5-propylpiperidin-3-amine
CID 83996677
3-[1-butyl-5-(2,2-difluoroethylamino)piperidin-3-yl]propan-1-ol
CID 83992872
2-[3-(cyclopentylmethylamino)-5-(3-hydroxypropyl)piperidin-1-yl]acetamide
CID 83998219
3-[1-(cyclobutylmethyl)-5-(propylamino)piperidin-3-yl]propan-1-ol
CID 83991255
2-[3-(cyclopropylamino)-5-propylpiperidin-1-yl]ethanol
CID 83991999
1-[5-(cyclobutylmethylamino)-1-propylpiperidin-3-yl]butan-2-ol
CID 83996988
5-butyl-N-cyclohexyl-1-propylpiperidin-3-amine
CID 83999048

Frequently Asked Questions

What is the IUPAC name of 3-[5-(cyclopropylmethylamino)-1-propylpiperidin-3-yl]propan-1-ol?
The IUPAC name of 3-[5-(cyclopropylmethylamino)-1-propylpiperidin-3-yl]propan-1-ol (CID 83996295) is 3-[5-(cyclopropylmethylamino)-1-propylpiperidin-3-yl]propan-1-ol.
What is the SMILES notation for 3-[5-(cyclopropylmethylamino)-1-propylpiperidin-3-yl]propan-1-ol?
The canonical SMILES for 3-[5-(cyclopropylmethylamino)-1-propylpiperidin-3-yl]propan-1-ol is CCCN1CC(CCCO)CC(NCC2CC2)C1.
What is the InChIKey of 3-[5-(cyclopropylmethylamino)-1-propylpiperidin-3-yl]propan-1-ol?
The InChIKey is BNHZGVLXUHPMQP-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H30N2O/c1-2-7-17-11-14(4-3-8-18)9-15(12-17)16-10-13-5-6-13/h13-16,18H,2-12H2,1H3.
What are the key properties of 3-[5-(cyclopropylmethylamino)-1-propylpiperidin-3-yl]propan-1-ol?
3-[5-(cyclopropylmethylamino)-1-propylpiperidin-3-yl]propan-1-ol has a molecular weight of 254.42 g/mol, XLogP of 1.86, 8 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[5-(cyclopropylmethylamino)-1-propylpiperidin-3-yl]propan-1-ol is sourced from PubChem (CID 83996295), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).