(2R)-2-amino-N-ethyl-N-[(6-methyl-2-pyridinyl)methyl]pentanamide

C14H23N3O — CID 113267614

IUPAC(2R)-2-amino-N-ethyl-N-[(6-methyl-2-pyridinyl)methyl]pentanamide
SMILESCCC[C@@H](N)C(=O)N(CC)Cc1cccc(C)n1
InChIInChI=1S/C14H23N3O/c1-4-7-13(15)14(18)17(5-2)10-12-9-6-8-11(3)16-12/h6,8-9,13H,4-5,7,10,15H2,1-3H3/t13-/m1/s1
InChIKeyLGDGUEZJXUOZME-CYBMUJFWSA-N
MW249.36 g/mol
LogP1.87
Rot. Bonds6

About (2R)-2-amino-N-ethyl-N-[(6-methyl-2-pyridinyl)methyl]pentanamide

(2R)-2-amino-N-ethyl-N-[(6-methyl-2-pyridinyl)methyl]pentanamide (PubChem CID 113267614) has the molecular formula C14H23N3O and a molecular weight of 249.36 g/mol. Its IUPAC name is (2R)-2-amino-N-ethyl-N-[(6-methyl-2-pyridinyl)methyl]pentanamide.

Molecular Properties

Compound Name(2R)-2-amino-N-ethyl-N-[(6-methyl-2-pyridinyl)methyl]pentanamide
PubChem CID113267614
Molecular FormulaC14H23N3O
Molecular Weight249.36 g/mol
Exact Mass249.18
IUPAC Name(2R)-2-amino-N-ethyl-N-[(6-methyl-2-pyridinyl)methyl]pentanamide
SMILESCCC[C@@H](N)C(=O)N(CC)Cc1cccc(C)n1
InChIInChI=1S/C14H23N3O/c1-4-7-13(15)14(18)17(5-2)10-12-9-6-8-11(3)16-12/h6,8-9,13H,4-5,7,10,15H2,1-3H3/t13-/m1/s1
InChIKeyLGDGUEZJXUOZME-CYBMUJFWSA-N
XLogP1.87
TPSA59.22 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 ≤ 51.87
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

3-amino-N-ethyl-2-methoxy-N-[(6-methyl-2-pyridinyl)methyl]propanamide
CID 114145142
4-amino-N,N-bis[(6-methyl-2-pyridinyl)methyl]pentanamide;trihydrochloride
CID 120566072
ethyl 2-[ethyl-[(6-methyl-2-pyridinyl)methyl]amino]pentanoate
CID 82838965
2-amino-N-ethyl-N-(pyridin-4-ylmethyl)pentanamide
CID 54873793
2-amino-N-methyl-2-(4-methylphenyl)-N-[(6-methyl-2-pyridinyl)methyl]acetamide
CID 106151730
1-ethyl-1-[(6-methyl-2-pyridinyl)methyl]-3-propan-2-ylthiourea
CID 113254044
(2R)-2-amino-N-ethyl-N-(furan-2-ylmethyl)pentanamide
CID 107568950
(2S)-2-amino-N-ethyl-N-[(4-methoxyphenyl)methyl]pentanamide
CID 93372926
6-bromo-N-ethyl-N-[(6-methyl-2-pyridinyl)methyl]pyridine-2-carboxamide
CID 103890041
2-(azetidin-3-ylidene)-N-ethyl-N-[(6-methyl-2-pyridinyl)methyl]propanamide
CID 116678469
(2S)-3-[[ethyl-[(6-methyl-2-pyridinyl)methyl]carbamoyl]amino]-2-hydroxypropanoic acid
CID 107840515
2-amino-N-ethyl-N-(furan-3-ylmethyl)pentanamide
CID 86784232

Frequently Asked Questions

What is the IUPAC name of (2R)-2-amino-N-ethyl-N-[(6-methyl-2-pyridinyl)methyl]pentanamide?
The IUPAC name of (2R)-2-amino-N-ethyl-N-[(6-methyl-2-pyridinyl)methyl]pentanamide (CID 113267614) is (2R)-2-amino-N-ethyl-N-[(6-methyl-2-pyridinyl)methyl]pentanamide.
What is the SMILES notation for (2R)-2-amino-N-ethyl-N-[(6-methyl-2-pyridinyl)methyl]pentanamide?
The canonical SMILES for (2R)-2-amino-N-ethyl-N-[(6-methyl-2-pyridinyl)methyl]pentanamide is CCC[C@@H](N)C(=O)N(CC)Cc1cccc(C)n1.
What is the InChIKey of (2R)-2-amino-N-ethyl-N-[(6-methyl-2-pyridinyl)methyl]pentanamide?
The InChIKey is LGDGUEZJXUOZME-CYBMUJFWSA-N. The full InChI is InChI=1S/C14H23N3O/c1-4-7-13(15)14(18)17(5-2)10-12-9-6-8-11(3)16-12/h6,8-9,13H,4-5,7,10,15H2,1-3H3/t13-/m1/s1.
What are the key properties of (2R)-2-amino-N-ethyl-N-[(6-methyl-2-pyridinyl)methyl]pentanamide?
(2R)-2-amino-N-ethyl-N-[(6-methyl-2-pyridinyl)methyl]pentanamide has a molecular weight of 249.36 g/mol, XLogP of 1.87, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-2-amino-N-ethyl-N-[(6-methyl-2-pyridinyl)methyl]pentanamide is sourced from PubChem (CID 113267614), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).