N-propan-2-yl-5-(2-propylpiperidin-1-yl)pentan-1-amine

C16H34N2 — CID 83061777

IUPACN-propan-2-yl-5-(2-propylpiperidin-1-yl)pentan-1-amine
SMILESCCCC1CCCCN1CCCCCNC(C)C
InChIInChI=1S/C16H34N2/c1-4-10-16-11-6-9-14-18(16)13-8-5-7-12-17-15(2)3/h15-17H,4-14H2,1-3H3
InChIKeyXEQXLOJYYKENKF-UHFFFAOYSA-N
MW254.46 g/mol
LogP3.81
Rot. Bonds9

About N-propan-2-yl-5-(2-propylpiperidin-1-yl)pentan-1-amine

N-propan-2-yl-5-(2-propylpiperidin-1-yl)pentan-1-amine (PubChem CID 83061777) has the molecular formula C16H34N2 and a molecular weight of 254.46 g/mol. Its IUPAC name is N-propan-2-yl-5-(2-propylpiperidin-1-yl)pentan-1-amine.

Molecular Properties

Compound NameN-propan-2-yl-5-(2-propylpiperidin-1-yl)pentan-1-amine
PubChem CID83061777
Molecular FormulaC16H34N2
Molecular Weight254.46 g/mol
Exact Mass254.27
IUPAC NameN-propan-2-yl-5-(2-propylpiperidin-1-yl)pentan-1-amine
SMILESCCCC1CCCCN1CCCCCNC(C)C
InChIInChI=1S/C16H34N2/c1-4-10-16-11-6-9-14-18(16)13-8-5-7-12-17-15(2)3/h15-17H,4-14H2,1-3H3
InChIKeyXEQXLOJYYKENKF-UHFFFAOYSA-N
XLogP3.81
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds9
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500254.46
LogP ≤ 53.81
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

N-(2-methylpropyl)-5-(2-propylpiperidin-1-yl)pentan-1-amine
CID 83061694
1-pentyl-2-propylpiperidine
CID 54429991
6-(2-propylpiperidin-1-yl)hexane-1-thiol
CID 83057539
N-(2-methoxyethyl)-4-(2-propylpiperidin-1-yl)butan-1-amine
CID 83061940
[1-[4-(propan-2-ylamino)butyl]pyrrolidin-2-yl]methanol
CID 115905715
2-butyl-1-hexylpiperidine
CID 171569565
1-decyl-2-propylpyrrolidine;hydrochloride
CID 175874875
5-(2-propylpiperidin-1-yl)pentanenitrile
CID 83056574
3-(2-propylpiperidin-1-yl)propan-1-amine
CID 83052825
2-butyl-1-hexylpiperidine;hydrofluoride
CID 175874869
1-decyl-2-propylpiperidine;trifluoromethanesulfonic acid
CID 175874740
N-methyl-6-(2-propylpiperidin-1-yl)hexan-3-amine
CID 106800080

Frequently Asked Questions

What is the IUPAC name of N-propan-2-yl-5-(2-propylpiperidin-1-yl)pentan-1-amine?
The IUPAC name of N-propan-2-yl-5-(2-propylpiperidin-1-yl)pentan-1-amine (CID 83061777) is N-propan-2-yl-5-(2-propylpiperidin-1-yl)pentan-1-amine.
What is the SMILES notation for N-propan-2-yl-5-(2-propylpiperidin-1-yl)pentan-1-amine?
The canonical SMILES for N-propan-2-yl-5-(2-propylpiperidin-1-yl)pentan-1-amine is CCCC1CCCCN1CCCCCNC(C)C.
What is the InChIKey of N-propan-2-yl-5-(2-propylpiperidin-1-yl)pentan-1-amine?
The InChIKey is XEQXLOJYYKENKF-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H34N2/c1-4-10-16-11-6-9-14-18(16)13-8-5-7-12-17-15(2)3/h15-17H,4-14H2,1-3H3.
What are the key properties of N-propan-2-yl-5-(2-propylpiperidin-1-yl)pentan-1-amine?
N-propan-2-yl-5-(2-propylpiperidin-1-yl)pentan-1-amine has a molecular weight of 254.46 g/mol, XLogP of 3.81, 9 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-propan-2-yl-5-(2-propylpiperidin-1-yl)pentan-1-amine is sourced from PubChem (CID 83061777), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).