(2R)-2-amino-N-[2-(dimethylamino)-3-pyridinyl]pentanamide

C12H20N4O — CID 107568545

IUPAC(2R)-2-amino-N-[2-(dimethylamino)-3-pyridinyl]pentanamide
SMILESCCC[C@@H](N)C(=O)Nc1cccnc1N(C)C
InChIInChI=1S/C12H20N4O/c1-4-6-9(13)12(17)15-10-7-5-8-14-11(10)16(2)3/h5,7-9H,4,6,13H2,1-3H3,(H,15,17)/t9-/m1/s1
InChIKeyOVQMFPAEVONIKY-SECBINFHSA-N
MW236.32 g/mol
LogP1.21
Rot. Bonds5

About (2R)-2-amino-N-[2-(dimethylamino)-3-pyridinyl]pentanamide

(2R)-2-amino-N-[2-(dimethylamino)-3-pyridinyl]pentanamide (PubChem CID 107568545) has the molecular formula C12H20N4O and a molecular weight of 236.32 g/mol. Its IUPAC name is (2R)-2-amino-N-[2-(dimethylamino)-3-pyridinyl]pentanamide.

Molecular Properties

Compound Name(2R)-2-amino-N-[2-(dimethylamino)-3-pyridinyl]pentanamide
PubChem CID107568545
Molecular FormulaC12H20N4O
Molecular Weight236.32 g/mol
Exact Mass236.16
IUPAC Name(2R)-2-amino-N-[2-(dimethylamino)-3-pyridinyl]pentanamide
SMILESCCC[C@@H](N)C(=O)Nc1cccnc1N(C)C
InChIInChI=1S/C12H20N4O/c1-4-6-9(13)12(17)15-10-7-5-8-14-11(10)16(2)3/h5,7-9H,4,6,13H2,1-3H3,(H,15,17)/t9-/m1/s1
InChIKeyOVQMFPAEVONIKY-SECBINFHSA-N
XLogP1.21
TPSA71.25 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500236.32
LogP ≤ 51.21
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

3-amino-4-[[2-(dimethylamino)-3-pyridinyl]amino]-4-oxobutanoic acid
CID 64896477
2-amino-N-[2-(dimethylamino)-3-pyridinyl]butanediamide
CID 54928517
(2S)-2-amino-N-[2-(dimethylamino)-3-pyridinyl]-3-methylpentanamide
CID 61173712
(2R)-2-amino-N-quinolin-8-ylpentanamide
CID 103813268
(2S)-2-amino-N-(3-hydroxy-2-pyridinyl)pentanamide
CID 107570512
2-amino-N-(2-pyrazol-1-yl-3-pyridinyl)pentanamide
CID 43714225
2-amino-N-[2-[(dimethylamino)methyl]phenyl]pentanamide
CID 43695727
(2R)-2-amino-N-(3-methyl-2-pyridinyl)pentanamide
CID 107568105
(2R)-2-amino-N-[3-chloro-2-(dimethylamino)phenyl]pentanamide
CID 103813583
(2S)-2-amino-N-[2-[[2-(dimethylamino)-3-pyridinyl]amino]-2-oxoethyl]-3-methylbutanamide
CID 82963467
2-amino-N-(2-morpholin-4-yl-3-pyridinyl)pentanamide;dihydrochloride
CID 119845832
3-[[2-(dimethylamino)-3-pyridinyl]amino]-3-oxopropanoic acid
CID 62230948

Frequently Asked Questions

What is the IUPAC name of (2R)-2-amino-N-[2-(dimethylamino)-3-pyridinyl]pentanamide?
The IUPAC name of (2R)-2-amino-N-[2-(dimethylamino)-3-pyridinyl]pentanamide (CID 107568545) is (2R)-2-amino-N-[2-(dimethylamino)-3-pyridinyl]pentanamide.
What is the SMILES notation for (2R)-2-amino-N-[2-(dimethylamino)-3-pyridinyl]pentanamide?
The canonical SMILES for (2R)-2-amino-N-[2-(dimethylamino)-3-pyridinyl]pentanamide is CCC[C@@H](N)C(=O)Nc1cccnc1N(C)C.
What is the InChIKey of (2R)-2-amino-N-[2-(dimethylamino)-3-pyridinyl]pentanamide?
The InChIKey is OVQMFPAEVONIKY-SECBINFHSA-N. The full InChI is InChI=1S/C12H20N4O/c1-4-6-9(13)12(17)15-10-7-5-8-14-11(10)16(2)3/h5,7-9H,4,6,13H2,1-3H3,(H,15,17)/t9-/m1/s1.
What are the key properties of (2R)-2-amino-N-[2-(dimethylamino)-3-pyridinyl]pentanamide?
(2R)-2-amino-N-[2-(dimethylamino)-3-pyridinyl]pentanamide has a molecular weight of 236.32 g/mol, XLogP of 1.21, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-2-amino-N-[2-(dimethylamino)-3-pyridinyl]pentanamide is sourced from PubChem (CID 107568545), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).