N-methyl-2-[2-[[(2R)-1,2,3,4-tetrahydronaphthalen-2-yl]carbamoylamino]phenyl]acetamide

C20H23N3O2 — CID 95157964

IUPACN-methyl-2-[2-[[(2R)-1,2,3,4-tetrahydronaphthalen-2-yl]carbamoylamino]phenyl]acetamide
SMILESCNC(=O)Cc1ccccc1NC(=O)N[C@@H]1CCc2ccccc2C1
InChIInChI=1S/C20H23N3O2/c1-21-19(24)13-16-8-4-5-9-18(16)23-20(25)22-17-11-10-14-6-2-3-7-15(14)12-17/h2-9,17H,10-13H2,1H3,(H,21,24)(H2,22,23,25)/t17-/m1/s1
InChIKeyGKDPZUIUVXZNPF-QGZVFWFLSA-N
MW337.42 g/mol
LogP2.65
Rot. Bonds4

About N-methyl-2-[2-[[(2R)-1,2,3,4-tetrahydronaphthalen-2-yl]carbamoylamino]phenyl]acetamide

N-methyl-2-[2-[[(2R)-1,2,3,4-tetrahydronaphthalen-2-yl]carbamoylamino]phenyl]acetamide (PubChem CID 95157964) has the molecular formula C20H23N3O2 and a molecular weight of 337.42 g/mol. Its IUPAC name is N-methyl-2-[2-[[(2R)-1,2,3,4-tetrahydronaphthalen-2-yl]carbamoylamino]phenyl]acetamide.

Molecular Properties

Compound NameN-methyl-2-[2-[[(2R)-1,2,3,4-tetrahydronaphthalen-2-yl]carbamoylamino]phenyl]acetamide
PubChem CID95157964
Molecular FormulaC20H23N3O2
Molecular Weight337.42 g/mol
Exact Mass337.18
IUPAC NameN-methyl-2-[2-[[(2R)-1,2,3,4-tetrahydronaphthalen-2-yl]carbamoylamino]phenyl]acetamide
SMILESCNC(=O)Cc1ccccc1NC(=O)N[C@@H]1CCc2ccccc2C1
InChIInChI=1S/C20H23N3O2/c1-21-19(24)13-16-8-4-5-9-18(16)23-20(25)22-17-11-10-14-6-2-3-7-15(14)12-17/h2-9,17H,10-13H2,1H3,(H,21,24)(H2,22,23,25)/t17-/m1/s1
InChIKeyGKDPZUIUVXZNPF-QGZVFWFLSA-N
XLogP2.65
TPSA70.23 Ų
H-Bond Donors3
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500337.42
LogP ≤ 52.65
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 102

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Related Compounds

N-[(2R)-1,2,3,4-tetrahydronaphthalen-2-yl]propanamide
CID 68917081
3-oxo-N-(1,2,3,4-tetrahydronaphthalen-2-yl)butanamide
CID 62305100
2-methyl-3-(methylamino)-N-(1,2,3,4-tetrahydronaphthalen-2-yl)propanamide
CID 79202769
1-cyclohexyl-3-(1,2,3,4-tetrahydronaphthalen-2-yl)urea
CID 115573941
2-chloro-N-(1,2,3,4-tetrahydronaphthalen-2-yl)acetamide
CID 11775776
(2R)-2-amino-N-(1,2,3,4-tetrahydronaphthalen-2-yl)propanamide;hydrochloride
CID 119270502
N-methyl-2-[2-[(1-methylpiperidin-4-yl)amino]phenyl]acetamide
CID 43692186
2-amino-N-(1,2,3,4-tetrahydronaphthalen-2-yl)hexanamide
CID 62305097
1-(2-cyanophenyl)-3-(2,3-dihydro-1H-inden-2-yl)urea
CID 23934831
1-cyclopropyl-3-[2-(hydroxymethyl)phenyl]urea
CID 62699685
2-propan-2-yloxy-N-(1,2,3,4-tetrahydronaphthalen-2-yl)acetamide
CID 112686633
1-(3-methylpyridazin-4-yl)-3-[(6S)-6,7,8,9-tetrahydro-5H-benzo[7]annulen-6-yl]urea
CID 164637021

Frequently Asked Questions

What is the IUPAC name of N-methyl-2-[2-[[(2R)-1,2,3,4-tetrahydronaphthalen-2-yl]carbamoylamino]phenyl]acetamide?
The IUPAC name of N-methyl-2-[2-[[(2R)-1,2,3,4-tetrahydronaphthalen-2-yl]carbamoylamino]phenyl]acetamide (CID 95157964) is N-methyl-2-[2-[[(2R)-1,2,3,4-tetrahydronaphthalen-2-yl]carbamoylamino]phenyl]acetamide.
What is the SMILES notation for N-methyl-2-[2-[[(2R)-1,2,3,4-tetrahydronaphthalen-2-yl]carbamoylamino]phenyl]acetamide?
The canonical SMILES for N-methyl-2-[2-[[(2R)-1,2,3,4-tetrahydronaphthalen-2-yl]carbamoylamino]phenyl]acetamide is CNC(=O)Cc1ccccc1NC(=O)N[C@@H]1CCc2ccccc2C1.
What is the InChIKey of N-methyl-2-[2-[[(2R)-1,2,3,4-tetrahydronaphthalen-2-yl]carbamoylamino]phenyl]acetamide?
The InChIKey is GKDPZUIUVXZNPF-QGZVFWFLSA-N. The full InChI is InChI=1S/C20H23N3O2/c1-21-19(24)13-16-8-4-5-9-18(16)23-20(25)22-17-11-10-14-6-2-3-7-15(14)12-17/h2-9,17H,10-13H2,1H3,(H,21,24)(H2,22,23,25)/t17-/m1/s1.
What are the key properties of N-methyl-2-[2-[[(2R)-1,2,3,4-tetrahydronaphthalen-2-yl]carbamoylamino]phenyl]acetamide?
N-methyl-2-[2-[[(2R)-1,2,3,4-tetrahydronaphthalen-2-yl]carbamoylamino]phenyl]acetamide has a molecular weight of 337.42 g/mol, XLogP of 2.65, 4 rotatable bonds, 3 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-2-[2-[[(2R)-1,2,3,4-tetrahydronaphthalen-2-yl]carbamoylamino]phenyl]acetamide is sourced from PubChem (CID 95157964), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).