2,2-dimethyl-N-(2-piperidin-4-ylethyl)pentan-1-amine

C14H30N2 — CID 115211733

IUPAC2,2-dimethyl-N-(2-piperidin-4-ylethyl)pentan-1-amine
SMILESCCCC(C)(C)CNCCC1CCNCC1
InChIInChI=1S/C14H30N2/c1-4-8-14(2,3)12-16-11-7-13-5-9-15-10-6-13/h13,15-16H,4-12H2,1-3H3
InChIKeyFPQPVUTUDLKRCV-UHFFFAOYSA-N
MW226.41 g/mol
LogP2.79
Rot. Bonds7

About 2,2-dimethyl-N-(2-piperidin-4-ylethyl)pentan-1-amine

2,2-dimethyl-N-(2-piperidin-4-ylethyl)pentan-1-amine (PubChem CID 115211733) has the molecular formula C14H30N2 and a molecular weight of 226.41 g/mol. Its IUPAC name is 2,2-dimethyl-N-(2-piperidin-4-ylethyl)pentan-1-amine.

Molecular Properties

Compound Name2,2-dimethyl-N-(2-piperidin-4-ylethyl)pentan-1-amine
PubChem CID115211733
Molecular FormulaC14H30N2
Molecular Weight226.41 g/mol
Exact Mass226.24
IUPAC Name2,2-dimethyl-N-(2-piperidin-4-ylethyl)pentan-1-amine
SMILESCCCC(C)(C)CNCCC1CCNCC1
InChIInChI=1S/C14H30N2/c1-4-8-14(2,3)12-16-11-7-13-5-9-15-10-6-13/h13,15-16H,4-12H2,1-3H3
InChIKeyFPQPVUTUDLKRCV-UHFFFAOYSA-N
XLogP2.79
TPSA24.06 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500226.41
LogP ≤ 52.79
H-Bond Donors ≤ 52
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-(azetidin-3-yl)ethyl]-2,2-dimethylheptan-1-amine
CID 116680290
N-(2-cyclohexylethyl)-2,2-dimethylbutane-1,4-diamine
CID 115204587
2,2-dimethyl-N-(2-piperidin-4-ylsulfanylethyl)heptan-1-amine
CID 114628792
ethane;4-propylpiperidine
CID 142071399
N-(2-cyclohexylethyl)-4-methoxy-2,2-dimethylbutan-1-amine
CID 103529191
2,2-dimethyl-N-(piperidin-2-ylmethyl)pentan-1-amine
CID 115209445
2,2-difluoro-N-(2-piperidin-4-ylethyl)ethanamine
CID 115407412
1-ethyl-3-(2-piperidin-4-ylethyl)urea
CID 60903315
2,2-dimethyl-N-(3-methylbutyl)pentan-1-amine
CID 138459549
3-(2-cyclohexylethylamino)-2,2-dimethylpropan-1-ol
CID 81411941
N-(2,2-dimethylbutyl)-2,2-dimethylpentan-1-amine
CID 88877913
tert-butyl N-[2-(2-piperidin-4-ylethylamino)ethyl]carbamate
CID 163448402

Frequently Asked Questions

What is the IUPAC name of 2,2-dimethyl-N-(2-piperidin-4-ylethyl)pentan-1-amine?
The IUPAC name of 2,2-dimethyl-N-(2-piperidin-4-ylethyl)pentan-1-amine (CID 115211733) is 2,2-dimethyl-N-(2-piperidin-4-ylethyl)pentan-1-amine.
What is the SMILES notation for 2,2-dimethyl-N-(2-piperidin-4-ylethyl)pentan-1-amine?
The canonical SMILES for 2,2-dimethyl-N-(2-piperidin-4-ylethyl)pentan-1-amine is CCCC(C)(C)CNCCC1CCNCC1.
What is the InChIKey of 2,2-dimethyl-N-(2-piperidin-4-ylethyl)pentan-1-amine?
The InChIKey is FPQPVUTUDLKRCV-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H30N2/c1-4-8-14(2,3)12-16-11-7-13-5-9-15-10-6-13/h13,15-16H,4-12H2,1-3H3.
What are the key properties of 2,2-dimethyl-N-(2-piperidin-4-ylethyl)pentan-1-amine?
2,2-dimethyl-N-(2-piperidin-4-ylethyl)pentan-1-amine has a molecular weight of 226.41 g/mol, XLogP of 2.79, 7 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2,2-dimethyl-N-(2-piperidin-4-ylethyl)pentan-1-amine is sourced from PubChem (CID 115211733), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).