(2R)-2-amino-N-methyl-N-[2-(2-methylpropylamino)-2-oxoethyl]pentanamide

C12H25N3O2 — CID 107570541

IUPAC(2R)-2-amino-N-methyl-N-[2-(2-methylpropylamino)-2-oxoethyl]pentanamide
SMILESCCC[C@@H](N)C(=O)N(C)CC(=O)NCC(C)C
InChIInChI=1S/C12H25N3O2/c1-5-6-10(13)12(17)15(4)8-11(16)14-7-9(2)3/h9-10H,5-8,13H2,1-4H3,(H,14,16)/t10-/m1/s1
InChIKeyFRCPTIQAEOCLAF-SNVBAGLBSA-N
MW243.35 g/mol
LogP0.34
Rot. Bonds7

About (2R)-2-amino-N-methyl-N-[2-(2-methylpropylamino)-2-oxoethyl]pentanamide

(2R)-2-amino-N-methyl-N-[2-(2-methylpropylamino)-2-oxoethyl]pentanamide (PubChem CID 107570541) has the molecular formula C12H25N3O2 and a molecular weight of 243.35 g/mol. Its IUPAC name is (2R)-2-amino-N-methyl-N-[2-(2-methylpropylamino)-2-oxoethyl]pentanamide.

Molecular Properties

Compound Name(2R)-2-amino-N-methyl-N-[2-(2-methylpropylamino)-2-oxoethyl]pentanamide
PubChem CID107570541
Molecular FormulaC12H25N3O2
Molecular Weight243.35 g/mol
Exact Mass243.19
IUPAC Name(2R)-2-amino-N-methyl-N-[2-(2-methylpropylamino)-2-oxoethyl]pentanamide
SMILESCCC[C@@H](N)C(=O)N(C)CC(=O)NCC(C)C
InChIInChI=1S/C12H25N3O2/c1-5-6-10(13)12(17)15(4)8-11(16)14-7-9(2)3/h9-10H,5-8,13H2,1-4H3,(H,14,16)/t10-/m1/s1
InChIKeyFRCPTIQAEOCLAF-SNVBAGLBSA-N
XLogP0.34
TPSA75.43 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500243.35
LogP ≤ 50.34
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

(2R)-2-amino-N-[2-(ethylamino)-2-oxoethyl]-N-methylpentanamide
CID 103795683
(2R)-2-amino-N-[2-(2-methoxyethylamino)-2-oxoethyl]-N-methylpentanamide
CID 93373594
3-amino-N,2-dimethyl-N-[2-(2-methylpropylamino)-2-oxoethyl]-3-sulfanylidenepropanamide
CID 113409349
(2S)-2-amino-N-[2-(dimethylamino)-2-oxoethyl]-N-methylpentanamide
CID 107568202
2-amino-N-methyl-N-(3-methylbutyl)pentanamide
CID 60963800
4-amino-5-[methyl-[2-oxo-2-(propylamino)ethyl]amino]-5-oxopentanoic acid
CID 64890082
(2R)-2-amino-N-ethyl-N-methylpentanamide
CID 93255557
2-amino-4-methoxy-N-methyl-N-[2-oxo-2-(propylamino)ethyl]butanamide
CID 62472504
2-amino-N-methyl-N-[2-oxo-2-(2,2,2-trifluoroethylamino)ethyl]hexanamide
CID 54871547
(2S)-2-amino-N-methyl-N-[2-(2-methylpropylamino)-2-oxoethyl]-2-phenylacetamide
CID 104898372
benzyl (3S)-3-amino-4-[methyl-[2-(2-methylpropylamino)-2-oxoethyl]amino]-4-oxobutanoate
CID 114274937
2-amino-N-[2-(2-methoxyethylamino)-2-oxoethyl]-N-methylhexanamide
CID 54873029

Frequently Asked Questions

What is the IUPAC name of (2R)-2-amino-N-methyl-N-[2-(2-methylpropylamino)-2-oxoethyl]pentanamide?
The IUPAC name of (2R)-2-amino-N-methyl-N-[2-(2-methylpropylamino)-2-oxoethyl]pentanamide (CID 107570541) is (2R)-2-amino-N-methyl-N-[2-(2-methylpropylamino)-2-oxoethyl]pentanamide.
What is the SMILES notation for (2R)-2-amino-N-methyl-N-[2-(2-methylpropylamino)-2-oxoethyl]pentanamide?
The canonical SMILES for (2R)-2-amino-N-methyl-N-[2-(2-methylpropylamino)-2-oxoethyl]pentanamide is CCC[C@@H](N)C(=O)N(C)CC(=O)NCC(C)C.
What is the InChIKey of (2R)-2-amino-N-methyl-N-[2-(2-methylpropylamino)-2-oxoethyl]pentanamide?
The InChIKey is FRCPTIQAEOCLAF-SNVBAGLBSA-N. The full InChI is InChI=1S/C12H25N3O2/c1-5-6-10(13)12(17)15(4)8-11(16)14-7-9(2)3/h9-10H,5-8,13H2,1-4H3,(H,14,16)/t10-/m1/s1.
What are the key properties of (2R)-2-amino-N-methyl-N-[2-(2-methylpropylamino)-2-oxoethyl]pentanamide?
(2R)-2-amino-N-methyl-N-[2-(2-methylpropylamino)-2-oxoethyl]pentanamide has a molecular weight of 243.35 g/mol, XLogP of 0.34, 7 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-2-amino-N-methyl-N-[2-(2-methylpropylamino)-2-oxoethyl]pentanamide is sourced from PubChem (CID 107570541), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).