N-ethyl-3-(3-ethylpiperidin-1-yl)-2,2-dimethylpropan-1-amine

C14H30N2 — CID 62257877

IUPACN-ethyl-3-(3-ethylpiperidin-1-yl)-2,2-dimethylpropan-1-amine
SMILESCCNCC(C)(C)CN1CCCC(CC)C1
InChIInChI=1S/C14H30N2/c1-5-13-8-7-9-16(10-13)12-14(3,4)11-15-6-2/h13,15H,5-12H2,1-4H3
InChIKeyLSVLMWKDMBMGCE-UHFFFAOYSA-N
MW226.41 g/mol
LogP2.74
Rot. Bonds6

About N-ethyl-3-(3-ethylpiperidin-1-yl)-2,2-dimethylpropan-1-amine

N-ethyl-3-(3-ethylpiperidin-1-yl)-2,2-dimethylpropan-1-amine (PubChem CID 62257877) has the molecular formula C14H30N2 and a molecular weight of 226.41 g/mol. Its IUPAC name is N-ethyl-3-(3-ethylpiperidin-1-yl)-2,2-dimethylpropan-1-amine.

Molecular Properties

Compound NameN-ethyl-3-(3-ethylpiperidin-1-yl)-2,2-dimethylpropan-1-amine
PubChem CID62257877
Molecular FormulaC14H30N2
Molecular Weight226.41 g/mol
Exact Mass226.24
IUPAC NameN-ethyl-3-(3-ethylpiperidin-1-yl)-2,2-dimethylpropan-1-amine
SMILESCCNCC(C)(C)CN1CCCC(CC)C1
InChIInChI=1S/C14H30N2/c1-5-13-8-7-9-16(10-13)12-14(3,4)11-15-6-2/h13,15H,5-12H2,1-4H3
InChIKeyLSVLMWKDMBMGCE-UHFFFAOYSA-N
XLogP2.74
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500226.41
LogP ≤ 52.74
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-ethyl-3-(3-ethylpiperidin-1-yl)-2-methyl-2-phenylpropan-1-amine
CID 62258575
N-ethyl-3-[3-(methoxymethyl)pyrrolidin-1-yl]-2,2-dimethylpropan-1-amine
CID 64583581
N-ethyl-4-(3-ethylpiperidin-1-yl)-3,3-dimethylbutan-2-amine
CID 66455139
4-(3-ethylpiperidin-1-yl)-3,3-dimethylbutan-2-one
CID 66453803
1-(3-ethylpiperidin-1-yl)-2-methylbutan-2-ol
CID 114495376
2-[(3-ethylpiperidin-1-yl)methyl]-2-methylpentanal
CID 62276202
1-(3-ethylpiperidin-1-yl)-2,3-dimethylbutan-2-ol
CID 114447622
4-(3-ethylpiperidin-1-yl)-3,3-dimethylbutan-2-amine
CID 66454924
3-ethyl-1-(2,2,3,4-tetramethylpentyl)piperidine
CID 134317869
N-[2-(3-ethylpiperidin-1-yl)ethyl]-3,3-dimethylbutan-1-amine
CID 62561731
3-(4-ethoxypiperidin-1-yl)-N-ethyl-2,2-dimethylpropan-1-amine
CID 62256195
3-(2,3-dimethylpiperidin-1-yl)-N-ethyl-2,2-dimethylpropan-1-amine
CID 62257221

Frequently Asked Questions

What is the IUPAC name of N-ethyl-3-(3-ethylpiperidin-1-yl)-2,2-dimethylpropan-1-amine?
The IUPAC name of N-ethyl-3-(3-ethylpiperidin-1-yl)-2,2-dimethylpropan-1-amine (CID 62257877) is N-ethyl-3-(3-ethylpiperidin-1-yl)-2,2-dimethylpropan-1-amine.
What is the SMILES notation for N-ethyl-3-(3-ethylpiperidin-1-yl)-2,2-dimethylpropan-1-amine?
The canonical SMILES for N-ethyl-3-(3-ethylpiperidin-1-yl)-2,2-dimethylpropan-1-amine is CCNCC(C)(C)CN1CCCC(CC)C1.
What is the InChIKey of N-ethyl-3-(3-ethylpiperidin-1-yl)-2,2-dimethylpropan-1-amine?
The InChIKey is LSVLMWKDMBMGCE-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H30N2/c1-5-13-8-7-9-16(10-13)12-14(3,4)11-15-6-2/h13,15H,5-12H2,1-4H3.
What are the key properties of N-ethyl-3-(3-ethylpiperidin-1-yl)-2,2-dimethylpropan-1-amine?
N-ethyl-3-(3-ethylpiperidin-1-yl)-2,2-dimethylpropan-1-amine has a molecular weight of 226.41 g/mol, XLogP of 2.74, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-3-(3-ethylpiperidin-1-yl)-2,2-dimethylpropan-1-amine is sourced from PubChem (CID 62257877), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).