2-[methyl-[2-oxo-2-(propan-2-ylamino)ethyl]amino]-N-(4-methyl-2-pyridinyl)acetamide

C14H22N4O2 — CID 51075766

IUPAC2-[methyl-[2-oxo-2-(propan-2-ylamino)ethyl]amino]-N-(4-methyl-2-pyridinyl)acetamide
SMILESCc1ccnc(NC(=O)CN(C)CC(=O)NC(C)C)c1
InChIInChI=1S/C14H22N4O2/c1-10(2)16-13(19)8-18(4)9-14(20)17-12-7-11(3)5-6-15-12/h5-7,10H,8-9H2,1-4H3,(H,16,19)(H,15,17,20)
InChIKeyFBWVZEMRSSYZDY-UHFFFAOYSA-N
MW278.36 g/mol
LogP0.78
Rot. Bonds6

About 2-[methyl-[2-oxo-2-(propan-2-ylamino)ethyl]amino]-N-(4-methyl-2-pyridinyl)acetamide

2-[methyl-[2-oxo-2-(propan-2-ylamino)ethyl]amino]-N-(4-methyl-2-pyridinyl)acetamide (PubChem CID 51075766) has the molecular formula C14H22N4O2 and a molecular weight of 278.36 g/mol. Its IUPAC name is 2-[methyl-[2-oxo-2-(propan-2-ylamino)ethyl]amino]-N-(4-methyl-2-pyridinyl)acetamide.

Molecular Properties

Compound Name2-[methyl-[2-oxo-2-(propan-2-ylamino)ethyl]amino]-N-(4-methyl-2-pyridinyl)acetamide
PubChem CID51075766
Molecular FormulaC14H22N4O2
Molecular Weight278.36 g/mol
Exact Mass278.17
IUPAC Name2-[methyl-[2-oxo-2-(propan-2-ylamino)ethyl]amino]-N-(4-methyl-2-pyridinyl)acetamide
SMILESCc1ccnc(NC(=O)CN(C)CC(=O)NC(C)C)c1
InChIInChI=1S/C14H22N4O2/c1-10(2)16-13(19)8-18(4)9-14(20)17-12-7-11(3)5-6-15-12/h5-7,10H,8-9H2,1-4H3,(H,16,19)(H,15,17,20)
InChIKeyFBWVZEMRSSYZDY-UHFFFAOYSA-N
XLogP0.78
TPSA74.33 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500278.36
LogP ≤ 50.78
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

methyl (2S)-2-[methyl-[2-[(4-methyl-2-pyridinyl)amino]-2-oxoethyl]amino]propanoate
CID 95294721
2-[methyl(methylsulfonyl)amino]-N-(4-methyl-2-pyridinyl)acetamide
CID 47351627
N-benzhydryl-3-[methyl-[2-[(4-methyl-2-pyridinyl)amino]-2-oxoethyl]amino]propanamide
CID 56526707
2-[methyl-[2-[(4-methyl-2-pyridinyl)amino]-2-oxoethyl]amino]-N-[[(2S)-oxolan-2-yl]methyl]acetamide
CID 95304590
N,4-dimethyl-N-[2-[(4-methyl-2-pyridinyl)amino]-2-oxoethyl]benzamide
CID 155944690
N-methyl-N-[2-[(4-methyl-2-pyridinyl)amino]-2-oxoethyl]cyclopentanecarboxamide
CID 166182865
3-amino-N-(4-methyl-2-pyridinyl)butanamide
CID 83618224
2-[[2-(2,4-dimethylphenyl)-2-oxoethyl]-methylamino]-N-propan-2-ylacetamide
CID 60681807
2-[methyl-[2-(3-methylphenyl)-2-oxoethyl]amino]-N-propan-2-ylacetamide
CID 62036179
2-[2,3-dihydro-1-benzofuran-7-ylmethyl(methyl)amino]-N-(4-methyl-2-pyridinyl)acetamide
CID 167952939
2-ethyl-N-(4-methyl-2-pyridinyl)butanamide
CID 849589
2-(dimethylamino)-N-(4-methyl-2-pyridinyl)butanamide
CID 71847661

Frequently Asked Questions

What is the IUPAC name of 2-[methyl-[2-oxo-2-(propan-2-ylamino)ethyl]amino]-N-(4-methyl-2-pyridinyl)acetamide?
The IUPAC name of 2-[methyl-[2-oxo-2-(propan-2-ylamino)ethyl]amino]-N-(4-methyl-2-pyridinyl)acetamide (CID 51075766) is 2-[methyl-[2-oxo-2-(propan-2-ylamino)ethyl]amino]-N-(4-methyl-2-pyridinyl)acetamide.
What is the SMILES notation for 2-[methyl-[2-oxo-2-(propan-2-ylamino)ethyl]amino]-N-(4-methyl-2-pyridinyl)acetamide?
The canonical SMILES for 2-[methyl-[2-oxo-2-(propan-2-ylamino)ethyl]amino]-N-(4-methyl-2-pyridinyl)acetamide is Cc1ccnc(NC(=O)CN(C)CC(=O)NC(C)C)c1.
What is the InChIKey of 2-[methyl-[2-oxo-2-(propan-2-ylamino)ethyl]amino]-N-(4-methyl-2-pyridinyl)acetamide?
The InChIKey is FBWVZEMRSSYZDY-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H22N4O2/c1-10(2)16-13(19)8-18(4)9-14(20)17-12-7-11(3)5-6-15-12/h5-7,10H,8-9H2,1-4H3,(H,16,19)(H,15,17,20).
What are the key properties of 2-[methyl-[2-oxo-2-(propan-2-ylamino)ethyl]amino]-N-(4-methyl-2-pyridinyl)acetamide?
2-[methyl-[2-oxo-2-(propan-2-ylamino)ethyl]amino]-N-(4-methyl-2-pyridinyl)acetamide has a molecular weight of 278.36 g/mol, XLogP of 0.78, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[methyl-[2-oxo-2-(propan-2-ylamino)ethyl]amino]-N-(4-methyl-2-pyridinyl)acetamide is sourced from PubChem (CID 51075766), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).