N,N,4-trimethyl-2-(pyridin-2-ylmethylamino)pentanamide

C14H23N3O — CID 43675023

IUPACN,N,4-trimethyl-2-(pyridin-2-ylmethylamino)pentanamide
SMILESCC(C)CC(NCc1ccccn1)C(=O)N(C)C
InChIInChI=1S/C14H23N3O/c1-11(2)9-13(14(18)17(3)4)16-10-12-7-5-6-8-15-12/h5-8,11,13,16H,9-10H2,1-4H3
InChIKeyMBFFSOIUKSTCRG-UHFFFAOYSA-N
MW249.36 g/mol
LogP1.67
Rot. Bonds6

About N,N,4-trimethyl-2-(pyridin-2-ylmethylamino)pentanamide

N,N,4-trimethyl-2-(pyridin-2-ylmethylamino)pentanamide (PubChem CID 43675023) has the molecular formula C14H23N3O and a molecular weight of 249.36 g/mol. Its IUPAC name is N,N,4-trimethyl-2-(pyridin-2-ylmethylamino)pentanamide.

Molecular Properties

Compound NameN,N,4-trimethyl-2-(pyridin-2-ylmethylamino)pentanamide
PubChem CID43675023
Molecular FormulaC14H23N3O
Molecular Weight249.36 g/mol
Exact Mass249.18
IUPAC NameN,N,4-trimethyl-2-(pyridin-2-ylmethylamino)pentanamide
SMILESCC(C)CC(NCc1ccccn1)C(=O)N(C)C
InChIInChI=1S/C14H23N3O/c1-11(2)9-13(14(18)17(3)4)16-10-12-7-5-6-8-15-12/h5-8,11,13,16H,9-10H2,1-4H3
InChIKeyMBFFSOIUKSTCRG-UHFFFAOYSA-N
XLogP1.67
TPSA45.23 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500249.36
LogP ≤ 51.67
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

zinc;bis((2S)-2-(pyridin-2-ylmethylamino)propanoate);hydrate
CID 139144713
(2R)-2-amino-N,N-dimethyl-3-pyridin-2-ylpropanamide
CID 73439082
(2R)-2-(methanesulfonamido)-4-methyl-N-(pyridin-2-ylmethyl)pentanamide
CID 94033690
N,4-dimethyl-2-[(4-methylphenyl)sulfonylamino]-N-(pyridin-2-ylmethyl)pentanamide
CID 60559293
3-methyl-2-(pyridin-2-ylmethylamino)butanamide
CID 67707485
methyl (3S)-3-(pyridin-2-ylmethylamino)butanoate
CID 93105864
4-[[[1-(dimethylamino)-4-methyl-1-oxopentan-2-yl]amino]methyl]benzoic acid
CID 65348249
1-N-ethyl-1-N-methyl-2-N-(pyridin-2-ylmethyl)propane-1,2-diamine
CID 103109745
2-methyl-N-(pyridin-2-ylmethyl)propan-1-amine;hydrochloride
CID 17332283
1-ethylsulfonyl-N-(pyridin-2-ylmethyl)propan-2-amine
CID 115626100
2-[(3-cyclopropylphenyl)methylamino]-N,N,4-trimethylpentanamide
CID 79969385
4-(4-methylphenyl)-4-oxo-3-(pyridin-2-ylmethylamino)butanoic acid
CID 82322309

Frequently Asked Questions

What is the IUPAC name of N,N,4-trimethyl-2-(pyridin-2-ylmethylamino)pentanamide?
The IUPAC name of N,N,4-trimethyl-2-(pyridin-2-ylmethylamino)pentanamide (CID 43675023) is N,N,4-trimethyl-2-(pyridin-2-ylmethylamino)pentanamide.
What is the SMILES notation for N,N,4-trimethyl-2-(pyridin-2-ylmethylamino)pentanamide?
The canonical SMILES for N,N,4-trimethyl-2-(pyridin-2-ylmethylamino)pentanamide is CC(C)CC(NCc1ccccn1)C(=O)N(C)C.
What is the InChIKey of N,N,4-trimethyl-2-(pyridin-2-ylmethylamino)pentanamide?
The InChIKey is MBFFSOIUKSTCRG-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H23N3O/c1-11(2)9-13(14(18)17(3)4)16-10-12-7-5-6-8-15-12/h5-8,11,13,16H,9-10H2,1-4H3.
What are the key properties of N,N,4-trimethyl-2-(pyridin-2-ylmethylamino)pentanamide?
N,N,4-trimethyl-2-(pyridin-2-ylmethylamino)pentanamide has a molecular weight of 249.36 g/mol, XLogP of 1.67, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N,N,4-trimethyl-2-(pyridin-2-ylmethylamino)pentanamide is sourced from PubChem (CID 43675023), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).