2-amino-N-[2-methyl-4-(2-methylpiperidine-1-carbonyl)phenyl]acetamide

C16H23N3O2 — CID 119305940

IUPAC2-amino-N-[2-methyl-4-(2-methylpiperidine-1-carbonyl)phenyl]acetamide
SMILESCc1cc(C(=O)N2CCCCC2C)ccc1NC(=O)CN
InChIInChI=1S/C16H23N3O2/c1-11-9-13(6-7-14(11)18-15(20)10-17)16(21)19-8-4-3-5-12(19)2/h6-7,9,12H,3-5,8,10,17H2,1-2H3,(H,18,20)
InChIKeyPBJGZCBTRNJJHT-UHFFFAOYSA-N
MW289.38 g/mol
LogP1.91
Rot. Bonds3

About 2-amino-N-[2-methyl-4-(2-methylpiperidine-1-carbonyl)phenyl]acetamide

2-amino-N-[2-methyl-4-(2-methylpiperidine-1-carbonyl)phenyl]acetamide (PubChem CID 119305940) has the molecular formula C16H23N3O2 and a molecular weight of 289.38 g/mol. Its IUPAC name is 2-amino-N-[2-methyl-4-(2-methylpiperidine-1-carbonyl)phenyl]acetamide.

Molecular Properties

Compound Name2-amino-N-[2-methyl-4-(2-methylpiperidine-1-carbonyl)phenyl]acetamide
PubChem CID119305940
Molecular FormulaC16H23N3O2
Molecular Weight289.38 g/mol
Exact Mass289.18
IUPAC Name2-amino-N-[2-methyl-4-(2-methylpiperidine-1-carbonyl)phenyl]acetamide
SMILESCc1cc(C(=O)N2CCCCC2C)ccc1NC(=O)CN
InChIInChI=1S/C16H23N3O2/c1-11-9-13(6-7-14(11)18-15(20)10-17)16(21)19-8-4-3-5-12(19)2/h6-7,9,12H,3-5,8,10,17H2,1-2H3,(H,18,20)
InChIKeyPBJGZCBTRNJJHT-UHFFFAOYSA-N
XLogP1.91
TPSA75.43 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500289.38
LogP ≤ 51.91
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

4-amino-3-methoxy-N-[2-methyl-4-(2-methylpiperidine-1-carbonyl)phenyl]butanamide
CID 120590472
N-[2-methyl-4-(2-methylpiperidine-1-carbonyl)phenyl]-2-(2-oxopyrimidin-1-yl)acetamide
CID 128950826
2-amino-N-[2-methyl-4-(2-methylpiperidine-1-carbonyl)phenyl]-2-(oxan-4-yl)acetamide
CID 120790160
(3R)-N-[2-methyl-4-[(2S)-2-methylpiperidine-1-carbonyl]phenyl]-1,1-dioxothiolane-3-carboxamide
CID 95279539
5-[[2-methyl-4-(2-methylpiperidine-1-carbonyl)phenyl]carbamoyl]pyridine-2-carboxylic acid
CID 119113859
2-methyl-N-[2-methyl-4-(2-methylpiperidine-1-carbonyl)phenyl]-3-phenylsulfanylpropanamide
CID 86933803
2-(diethylamino)-N-[2-methyl-4-(2-methylpiperidine-1-carbonyl)phenyl]-2-phenylacetamide
CID 56580263
[3-methyl-4-[(5-methylfuran-2-yl)methylamino]phenyl]-[(2R)-2-methylpiperidin-1-yl]methanone
CID 100623753
(2R)-2-(3,5-dimethyl-1,2-oxazol-4-yl)-N-[2-methyl-4-[(2S)-2-methylpiperidine-1-carbonyl]phenyl]propanamide
CID 95139458
4-[(2-aminoacetyl)amino]-N-cyclohexyl-3-methylbenzamide;hydrochloride
CID 119283092
2-N,2-N,6-trimethyl-5-N-[2-methyl-4-(2-methylpiperidine-1-carbonyl)phenyl]pyridine-2,5-dicarboxamide
CID 86890412
[3-(3-aminoprop-1-ynyl)-4-methylphenyl]-(2-methylazepan-1-yl)methanone
CID 81460594

Frequently Asked Questions

What is the IUPAC name of 2-amino-N-[2-methyl-4-(2-methylpiperidine-1-carbonyl)phenyl]acetamide?
The IUPAC name of 2-amino-N-[2-methyl-4-(2-methylpiperidine-1-carbonyl)phenyl]acetamide (CID 119305940) is 2-amino-N-[2-methyl-4-(2-methylpiperidine-1-carbonyl)phenyl]acetamide.
What is the SMILES notation for 2-amino-N-[2-methyl-4-(2-methylpiperidine-1-carbonyl)phenyl]acetamide?
The canonical SMILES for 2-amino-N-[2-methyl-4-(2-methylpiperidine-1-carbonyl)phenyl]acetamide is Cc1cc(C(=O)N2CCCCC2C)ccc1NC(=O)CN.
What is the InChIKey of 2-amino-N-[2-methyl-4-(2-methylpiperidine-1-carbonyl)phenyl]acetamide?
The InChIKey is PBJGZCBTRNJJHT-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H23N3O2/c1-11-9-13(6-7-14(11)18-15(20)10-17)16(21)19-8-4-3-5-12(19)2/h6-7,9,12H,3-5,8,10,17H2,1-2H3,(H,18,20).
What are the key properties of 2-amino-N-[2-methyl-4-(2-methylpiperidine-1-carbonyl)phenyl]acetamide?
2-amino-N-[2-methyl-4-(2-methylpiperidine-1-carbonyl)phenyl]acetamide has a molecular weight of 289.38 g/mol, XLogP of 1.91, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-N-[2-methyl-4-(2-methylpiperidine-1-carbonyl)phenyl]acetamide is sourced from PubChem (CID 119305940), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).