(4-amino-1-butylpiperidin-4-yl)methanol

C10H22N2O — CID 117012084

IUPAC(4-amino-1-butylpiperidin-4-yl)methanol
SMILESCCCCN1CCC(N)(CO)CC1
InChIInChI=1S/C10H22N2O/c1-2-3-6-12-7-4-10(11,9-13)5-8-12/h13H,2-9,11H2,1H3
InChIKeyNZGBJUPWKQGVQN-UHFFFAOYSA-N
MW186.30 g/mol
LogP0.57
Rot. Bonds4

About (4-amino-1-butylpiperidin-4-yl)methanol

(4-amino-1-butylpiperidin-4-yl)methanol (PubChem CID 117012084) has the molecular formula C10H22N2O and a molecular weight of 186.30 g/mol. Its IUPAC name is (4-amino-1-butylpiperidin-4-yl)methanol.

Molecular Properties

Compound Name(4-amino-1-butylpiperidin-4-yl)methanol
PubChem CID117012084
Molecular FormulaC10H22N2O
Molecular Weight186.30 g/mol
Exact Mass186.17
IUPAC Name(4-amino-1-butylpiperidin-4-yl)methanol
SMILESCCCCN1CCC(N)(CO)CC1
InChIInChI=1S/C10H22N2O/c1-2-3-6-12-7-4-10(11,9-13)5-8-12/h13H,2-9,11H2,1H3
InChIKeyNZGBJUPWKQGVQN-UHFFFAOYSA-N
XLogP0.57
TPSA49.49 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500186.30
LogP ≤ 50.57
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

4-amino-1-pentylpiperidine-4-carboxylic acid
CID 117011769
1-butyl-4-methylpiperidine-4-carboxylic acid
CID 63124911
1-hexyl-4-methylpiperidin-4-amine
CID 142516140
4-butyl-7,7-dimethyl-1,4-thiazepane
CID 130684561
3-amino-1-octylpyrrolidine-3-carboxylic acid
CID 107321089
(4-nonylpiperazin-1-yl)methanol
CID 574800
1-heptyl-4-methylpiperidine-4-carboxylic acid
CID 55176415
3-amino-1-butylpiperidine-3-carboxylic acid
CID 117011811
3-(4-butylpiperazin-1-yl)propan-1-amine
CID 15485218
[3-amino-1-(3-methylbutyl)pyrrolidin-3-yl]methanol
CID 117012217
(4-amino-1-tert-butylpiperidin-4-yl)methanol
CID 3742222
(3-amino-1-methylpyrrolidin-3-yl)methanol;ethane
CID 171517392

Frequently Asked Questions

What is the IUPAC name of (4-amino-1-butylpiperidin-4-yl)methanol?
The IUPAC name of (4-amino-1-butylpiperidin-4-yl)methanol (CID 117012084) is (4-amino-1-butylpiperidin-4-yl)methanol.
What is the SMILES notation for (4-amino-1-butylpiperidin-4-yl)methanol?
The canonical SMILES for (4-amino-1-butylpiperidin-4-yl)methanol is CCCCN1CCC(N)(CO)CC1.
What is the InChIKey of (4-amino-1-butylpiperidin-4-yl)methanol?
The InChIKey is NZGBJUPWKQGVQN-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H22N2O/c1-2-3-6-12-7-4-10(11,9-13)5-8-12/h13H,2-9,11H2,1H3.
What are the key properties of (4-amino-1-butylpiperidin-4-yl)methanol?
(4-amino-1-butylpiperidin-4-yl)methanol has a molecular weight of 186.30 g/mol, XLogP of 0.57, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (4-amino-1-butylpiperidin-4-yl)methanol is sourced from PubChem (CID 117012084), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).