N-ethyl-3,4,4-trimethyl-N-(piperidin-3-ylmethyl)pentanamide

C16H32N2O — CID 106629403

IUPACN-ethyl-3,4,4-trimethyl-N-(piperidin-3-ylmethyl)pentanamide
SMILESCCN(CC1CCCNC1)C(=O)CC(C)C(C)(C)C
InChIInChI=1S/C16H32N2O/c1-6-18(12-14-8-7-9-17-11-14)15(19)10-13(2)16(3,4)5/h13-14,17H,6-12H2,1-5H3
InChIKeyIUASOYOCYLDFNL-UHFFFAOYSA-N
MW268.44 g/mol
LogP2.91
Rot. Bonds5

About N-ethyl-3,4,4-trimethyl-N-(piperidin-3-ylmethyl)pentanamide

N-ethyl-3,4,4-trimethyl-N-(piperidin-3-ylmethyl)pentanamide (PubChem CID 106629403) has the molecular formula C16H32N2O and a molecular weight of 268.44 g/mol. Its IUPAC name is N-ethyl-3,4,4-trimethyl-N-(piperidin-3-ylmethyl)pentanamide.

Molecular Properties

Compound NameN-ethyl-3,4,4-trimethyl-N-(piperidin-3-ylmethyl)pentanamide
PubChem CID106629403
Molecular FormulaC16H32N2O
Molecular Weight268.44 g/mol
Exact Mass268.25
IUPAC NameN-ethyl-3,4,4-trimethyl-N-(piperidin-3-ylmethyl)pentanamide
SMILESCCN(CC1CCCNC1)C(=O)CC(C)C(C)(C)C
InChIInChI=1S/C16H32N2O/c1-6-18(12-14-8-7-9-17-11-14)15(19)10-13(2)16(3,4)5/h13-14,17H,6-12H2,1-5H3
InChIKeyIUASOYOCYLDFNL-UHFFFAOYSA-N
XLogP2.91
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500268.44
LogP ≤ 52.91
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-ethyl-N-(piperidin-3-ylmethyl)propanamide
CID 106629408
N-ethyl-3-methoxy-N-(piperidin-3-ylmethyl)propanamide
CID 106629400
N,3,4,4-tetramethyl-N-piperidin-3-ylpentanamide
CID 63833926
N-ethyl-3,4,4-trimethyl-N-pyrrolidin-3-ylpentanamide
CID 63833754
1,3-diethyl-1-(piperidin-3-ylmethyl)urea
CID 106629944
1-cyclopropyl-3,3-diethyl-1-(piperidin-3-ylmethyl)urea
CID 106629978
2-[(2-methylpropan-2-yl)oxy]-N-(piperidin-3-ylmethyl)-N-propylacetamide
CID 106628164
N-ethyl-2-(4-methoxyphenyl)-N-(piperidin-3-ylmethyl)acetamide
CID 106629299
ethyl N-(piperidin-3-ylmethyl)-N-propylcarbamate
CID 106630010
N-ethyl-3-imidazol-1-yl-N-(piperidin-3-ylmethyl)propanamide
CID 106629654
N-ethyl-N-(piperidin-3-ylmethyl)-2-(1,2,4-triazol-1-yl)propanamide
CID 106629632
N,N-bis(cyclopropylmethyl)-3-piperidin-3-ylbutanamide;hydrochloride
CID 119791148

Frequently Asked Questions

What is the IUPAC name of N-ethyl-3,4,4-trimethyl-N-(piperidin-3-ylmethyl)pentanamide?
The IUPAC name of N-ethyl-3,4,4-trimethyl-N-(piperidin-3-ylmethyl)pentanamide (CID 106629403) is N-ethyl-3,4,4-trimethyl-N-(piperidin-3-ylmethyl)pentanamide.
What is the SMILES notation for N-ethyl-3,4,4-trimethyl-N-(piperidin-3-ylmethyl)pentanamide?
The canonical SMILES for N-ethyl-3,4,4-trimethyl-N-(piperidin-3-ylmethyl)pentanamide is CCN(CC1CCCNC1)C(=O)CC(C)C(C)(C)C.
What is the InChIKey of N-ethyl-3,4,4-trimethyl-N-(piperidin-3-ylmethyl)pentanamide?
The InChIKey is IUASOYOCYLDFNL-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H32N2O/c1-6-18(12-14-8-7-9-17-11-14)15(19)10-13(2)16(3,4)5/h13-14,17H,6-12H2,1-5H3.
What are the key properties of N-ethyl-3,4,4-trimethyl-N-(piperidin-3-ylmethyl)pentanamide?
N-ethyl-3,4,4-trimethyl-N-(piperidin-3-ylmethyl)pentanamide has a molecular weight of 268.44 g/mol, XLogP of 2.91, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-3,4,4-trimethyl-N-(piperidin-3-ylmethyl)pentanamide is sourced from PubChem (CID 106629403), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).