6-amino-N-ethyl-4,4-dimethyl-N-(pyridin-4-ylmethyl)hexanamide

C16H27N3O — CID 65292091

IUPAC6-amino-N-ethyl-4,4-dimethyl-N-(pyridin-4-ylmethyl)hexanamide
SMILESCCN(Cc1ccncc1)C(=O)CCC(C)(C)CCN
InChIInChI=1S/C16H27N3O/c1-4-19(13-14-6-11-18-12-7-14)15(20)5-8-16(2,3)9-10-17/h6-7,11-12H,4-5,8-10,13,17H2,1-3H3
InChIKeyPDYMRNCIKGZMEV-UHFFFAOYSA-N
MW277.41 g/mol
LogP2.59
Rot. Bonds8

About 6-amino-N-ethyl-4,4-dimethyl-N-(pyridin-4-ylmethyl)hexanamide

6-amino-N-ethyl-4,4-dimethyl-N-(pyridin-4-ylmethyl)hexanamide (PubChem CID 65292091) has the molecular formula C16H27N3O and a molecular weight of 277.41 g/mol. Its IUPAC name is 6-amino-N-ethyl-4,4-dimethyl-N-(pyridin-4-ylmethyl)hexanamide.

Molecular Properties

Compound Name6-amino-N-ethyl-4,4-dimethyl-N-(pyridin-4-ylmethyl)hexanamide
PubChem CID65292091
Molecular FormulaC16H27N3O
Molecular Weight277.41 g/mol
Exact Mass277.22
IUPAC Name6-amino-N-ethyl-4,4-dimethyl-N-(pyridin-4-ylmethyl)hexanamide
SMILESCCN(Cc1ccncc1)C(=O)CCC(C)(C)CCN
InChIInChI=1S/C16H27N3O/c1-4-19(13-14-6-11-18-12-7-14)15(20)5-8-16(2,3)9-10-17/h6-7,11-12H,4-5,8-10,13,17H2,1-3H3
InChIKeyPDYMRNCIKGZMEV-UHFFFAOYSA-N
XLogP2.59
TPSA59.22 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500277.41
LogP ≤ 52.59
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

6-[ethyl(pyridin-4-ylmethyl)amino]-6-oxohexanoic acid
CID 54876323
2-(aminomethyl)-N-ethyl-2-methyl-N-(pyridin-4-ylmethyl)butanamide
CID 114290465
6-amino-N-ethyl-N-(2-hydroxy-2-methylpropyl)-4,4-dimethylhexanamide
CID 79379068
3-amino-N-ethyl-N-(2-pyridin-4-ylethyl)propanamide
CID 22692037
2-anilino-N-ethyl-N-(pyridin-4-ylmethyl)acetamide
CID 60962477
(2S)-2-amino-N-ethyl-3,3-dimethyl-N-(pyridin-4-ylmethyl)butanamide
CID 61162675
N-ethyl-2-phenyl-N-(pyridin-4-ylmethyl)acetamide
CID 564270
N,N-diethyl-3-pyridin-4-ylpropanamide
CID 78878654
3-amino-N-[(4-chlorophenyl)methyl]-N-ethylpropanamide
CID 92931902
2-[ethyl-[ethyl(pyridin-4-ylmethyl)carbamoyl]amino]-2-methylpropanoic acid
CID 62822188
N-ethyl-3-(4-methyl-1,3-thiazol-5-yl)-N-(pyridin-4-ylmethyl)propanamide
CID 70725804
N,N'-dibenzyl-N,N'-diethylpropanediamide
CID 2392254

Frequently Asked Questions

What is the IUPAC name of 6-amino-N-ethyl-4,4-dimethyl-N-(pyridin-4-ylmethyl)hexanamide?
The IUPAC name of 6-amino-N-ethyl-4,4-dimethyl-N-(pyridin-4-ylmethyl)hexanamide (CID 65292091) is 6-amino-N-ethyl-4,4-dimethyl-N-(pyridin-4-ylmethyl)hexanamide.
What is the SMILES notation for 6-amino-N-ethyl-4,4-dimethyl-N-(pyridin-4-ylmethyl)hexanamide?
The canonical SMILES for 6-amino-N-ethyl-4,4-dimethyl-N-(pyridin-4-ylmethyl)hexanamide is CCN(Cc1ccncc1)C(=O)CCC(C)(C)CCN.
What is the InChIKey of 6-amino-N-ethyl-4,4-dimethyl-N-(pyridin-4-ylmethyl)hexanamide?
The InChIKey is PDYMRNCIKGZMEV-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H27N3O/c1-4-19(13-14-6-11-18-12-7-14)15(20)5-8-16(2,3)9-10-17/h6-7,11-12H,4-5,8-10,13,17H2,1-3H3.
What are the key properties of 6-amino-N-ethyl-4,4-dimethyl-N-(pyridin-4-ylmethyl)hexanamide?
6-amino-N-ethyl-4,4-dimethyl-N-(pyridin-4-ylmethyl)hexanamide has a molecular weight of 277.41 g/mol, XLogP of 2.59, 8 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-amino-N-ethyl-4,4-dimethyl-N-(pyridin-4-ylmethyl)hexanamide is sourced from PubChem (CID 65292091), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).