N-carbamoyl-2-[[(1R)-1-(2-chlorophenyl)ethyl]amino]acetamide

C11H14ClN3O2 — CID 81377573

IUPACN-carbamoyl-2-[[(1R)-1-(2-chlorophenyl)ethyl]amino]acetamide
SMILESC[C@@H](NCC(=O)NC(N)=O)c1ccccc1Cl
InChIInChI=1S/C11H14ClN3O2/c1-7(8-4-2-3-5-9(8)12)14-6-10(16)15-11(13)17/h2-5,7,14H,6H2,1H3,(H3,13,15,16,17)/t7-/m1/s1
InChIKeyMKQRTKLQYRLOLV-SSDOTTSWSA-N
MW255.71 g/mol
LogP1.19
Rot. Bonds4

About N-carbamoyl-2-[[(1R)-1-(2-chlorophenyl)ethyl]amino]acetamide

N-carbamoyl-2-[[(1R)-1-(2-chlorophenyl)ethyl]amino]acetamide (PubChem CID 81377573) has the molecular formula C11H14ClN3O2 and a molecular weight of 255.71 g/mol. Its IUPAC name is N-carbamoyl-2-[[(1R)-1-(2-chlorophenyl)ethyl]amino]acetamide.

Molecular Properties

Compound NameN-carbamoyl-2-[[(1R)-1-(2-chlorophenyl)ethyl]amino]acetamide
PubChem CID81377573
Molecular FormulaC11H14ClN3O2
Molecular Weight255.71 g/mol
Exact Mass255.08
IUPAC NameN-carbamoyl-2-[[(1R)-1-(2-chlorophenyl)ethyl]amino]acetamide
SMILESC[C@@H](NCC(=O)NC(N)=O)c1ccccc1Cl
InChIInChI=1S/C11H14ClN3O2/c1-7(8-4-2-3-5-9(8)12)14-6-10(16)15-11(13)17/h2-5,7,14H,6H2,1H3,(H3,13,15,16,17)/t7-/m1/s1
InChIKeyMKQRTKLQYRLOLV-SSDOTTSWSA-N
XLogP1.19
TPSA84.22 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500255.71
LogP ≤ 51.19
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

2-[1-(2-chlorophenyl)ethylamino]-N-(1-phenylethyl)acetamide
CID 18085942
N-benzhydryl-2-[[(1S)-1-(2-chlorophenyl)ethyl]amino]acetamide
CID 9306893
2-[1-(2-chlorophenyl)ethylamino]-N-(2,6-dichlorophenyl)acetamide
CID 18085946
2-[[(1R)-1-(2-chlorophenyl)ethyl]amino]-N-pentan-3-ylacetamide
CID 81377630
2-[[(1S)-1-(2-chlorophenyl)ethyl]amino]-N-phenylacetamide
CID 32704244
2-[1-(2-chlorophenyl)ethylamino]-N-(dicyclopropylmethyl)acetamide
CID 86918952
2-[[(1S)-1-(2-chlorophenyl)ethyl]amino]-N-[(1S)-1-cyclopropylethyl]acetamide
CID 8599057
2-[1-(2-chlorophenyl)ethylamino]-N-prop-2-ynylacetamide
CID 47118036
2-[[(1R)-1-(2-chlorophenyl)ethyl]amino]-N-(propylcarbamoyl)acetamide
CID 9306320
2-[[(1R)-1-(2-chlorophenyl)ethyl]amino]-N-cyclopropylacetamide
CID 81378498
2-[[(1R)-1-(2-chlorophenyl)ethyl]amino]-N-[(2-chlorophenyl)methyl]acetamide
CID 9306793
2-[[(1R)-1-(2-chlorophenyl)ethyl]amino]-N-(2-methylphenyl)acetamide
CID 9306757

Frequently Asked Questions

What is the IUPAC name of N-carbamoyl-2-[[(1R)-1-(2-chlorophenyl)ethyl]amino]acetamide?
The IUPAC name of N-carbamoyl-2-[[(1R)-1-(2-chlorophenyl)ethyl]amino]acetamide (CID 81377573) is N-carbamoyl-2-[[(1R)-1-(2-chlorophenyl)ethyl]amino]acetamide.
What is the SMILES notation for N-carbamoyl-2-[[(1R)-1-(2-chlorophenyl)ethyl]amino]acetamide?
The canonical SMILES for N-carbamoyl-2-[[(1R)-1-(2-chlorophenyl)ethyl]amino]acetamide is C[C@@H](NCC(=O)NC(N)=O)c1ccccc1Cl.
What is the InChIKey of N-carbamoyl-2-[[(1R)-1-(2-chlorophenyl)ethyl]amino]acetamide?
The InChIKey is MKQRTKLQYRLOLV-SSDOTTSWSA-N. The full InChI is InChI=1S/C11H14ClN3O2/c1-7(8-4-2-3-5-9(8)12)14-6-10(16)15-11(13)17/h2-5,7,14H,6H2,1H3,(H3,13,15,16,17)/t7-/m1/s1.
What are the key properties of N-carbamoyl-2-[[(1R)-1-(2-chlorophenyl)ethyl]amino]acetamide?
N-carbamoyl-2-[[(1R)-1-(2-chlorophenyl)ethyl]amino]acetamide has a molecular weight of 255.71 g/mol, XLogP of 1.19, 4 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-carbamoyl-2-[[(1R)-1-(2-chlorophenyl)ethyl]amino]acetamide is sourced from PubChem (CID 81377573), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).