N-(4-methoxyphenyl)-2-[[(1S)-1-pyridin-2-ylethyl]amino]acetamide

C16H19N3O2 — CID 81393069

IUPACN-(4-methoxyphenyl)-2-[[(1S)-1-pyridin-2-ylethyl]amino]acetamide
SMILESCOc1ccc(NC(=O)CN[C@@H](C)c2ccccn2)cc1
InChIInChI=1S/C16H19N3O2/c1-12(15-5-3-4-10-17-15)18-11-16(20)19-13-6-8-14(21-2)9-7-13/h3-10,12,18H,11H2,1-2H3,(H,19,20)/t12-/m0/s1
InChIKeyUDQIYWKCXBXNRE-LBPRGKRZSA-N
MW285.35 g/mol
LogP2.38
Rot. Bonds6

About N-(4-methoxyphenyl)-2-[[(1S)-1-pyridin-2-ylethyl]amino]acetamide

N-(4-methoxyphenyl)-2-[[(1S)-1-pyridin-2-ylethyl]amino]acetamide (PubChem CID 81393069) has the molecular formula C16H19N3O2 and a molecular weight of 285.35 g/mol. Its IUPAC name is N-(4-methoxyphenyl)-2-[[(1S)-1-pyridin-2-ylethyl]amino]acetamide.

Molecular Properties

Compound NameN-(4-methoxyphenyl)-2-[[(1S)-1-pyridin-2-ylethyl]amino]acetamide
PubChem CID81393069
Molecular FormulaC16H19N3O2
Molecular Weight285.35 g/mol
Exact Mass285.15
IUPAC NameN-(4-methoxyphenyl)-2-[[(1S)-1-pyridin-2-ylethyl]amino]acetamide
SMILESCOc1ccc(NC(=O)CN[C@@H](C)c2ccccn2)cc1
InChIInChI=1S/C16H19N3O2/c1-12(15-5-3-4-10-17-15)18-11-16(20)19-13-6-8-14(21-2)9-7-13/h3-10,12,18H,11H2,1-2H3,(H,19,20)/t12-/m0/s1
InChIKeyUDQIYWKCXBXNRE-LBPRGKRZSA-N
XLogP2.38
TPSA63.25 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500285.35
LogP ≤ 52.38
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-(4-methylphenyl)-2-[[(1R)-1-pyridin-2-ylethyl]amino]acetamide
CID 81406656
N-(4-bromophenyl)-2-[[(1S)-1-pyridin-2-ylethyl]amino]acetamide
CID 81401760
2-[[(1S)-1-(4-methoxyphenyl)ethyl]amino]-N-phenylacetamide
CID 81368463
N-(3-chlorophenyl)-2-(1-pyridin-2-ylethylamino)acetamide
CID 43396868
N-(3-fluorophenyl)-2-[[(1R)-1-pyridin-2-ylethyl]amino]acetamide
CID 81407084
N-(2-methylphenyl)-2-[[(1S)-1-pyridin-2-ylethyl]amino]acetamide
CID 81401913
N-phenyl-3-(1-pyridin-2-ylethylamino)propanamide
CID 119106523
N-(2-chlorophenyl)-2-[[(1R)-1-pyridin-2-ylethyl]amino]acetamide
CID 81406571
ethyl 2-[[(1S)-1-pyridin-2-ylethyl]amino]acetate
CID 81401759
N-(2-methylpropyl)-2-[[(1R)-1-pyridin-2-ylethyl]amino]acetamide
CID 81406744
N-[4-(1-pyridin-2-ylethylamino)phenyl]propanamide
CID 43720633
2-[[(1S)-1-(4-chlorophenyl)ethyl]amino]-N-(4-methoxyphenyl)acetamide
CID 9335614

Frequently Asked Questions

What is the IUPAC name of N-(4-methoxyphenyl)-2-[[(1S)-1-pyridin-2-ylethyl]amino]acetamide?
The IUPAC name of N-(4-methoxyphenyl)-2-[[(1S)-1-pyridin-2-ylethyl]amino]acetamide (CID 81393069) is N-(4-methoxyphenyl)-2-[[(1S)-1-pyridin-2-ylethyl]amino]acetamide.
What is the SMILES notation for N-(4-methoxyphenyl)-2-[[(1S)-1-pyridin-2-ylethyl]amino]acetamide?
The canonical SMILES for N-(4-methoxyphenyl)-2-[[(1S)-1-pyridin-2-ylethyl]amino]acetamide is COc1ccc(NC(=O)CN[C@@H](C)c2ccccn2)cc1.
What is the InChIKey of N-(4-methoxyphenyl)-2-[[(1S)-1-pyridin-2-ylethyl]amino]acetamide?
The InChIKey is UDQIYWKCXBXNRE-LBPRGKRZSA-N. The full InChI is InChI=1S/C16H19N3O2/c1-12(15-5-3-4-10-17-15)18-11-16(20)19-13-6-8-14(21-2)9-7-13/h3-10,12,18H,11H2,1-2H3,(H,19,20)/t12-/m0/s1.
What are the key properties of N-(4-methoxyphenyl)-2-[[(1S)-1-pyridin-2-ylethyl]amino]acetamide?
N-(4-methoxyphenyl)-2-[[(1S)-1-pyridin-2-ylethyl]amino]acetamide has a molecular weight of 285.35 g/mol, XLogP of 2.38, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-methoxyphenyl)-2-[[(1S)-1-pyridin-2-ylethyl]amino]acetamide is sourced from PubChem (CID 81393069), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).