2-(5-amino-2-pyridinyl)-N-[1-(3-propan-2-yloxyphenyl)ethyl]acetamide

C18H23N3O2 — CID 120622083

IUPAC2-(5-amino-2-pyridinyl)-N-[1-(3-propan-2-yloxyphenyl)ethyl]acetamide
SMILESCC(C)Oc1cccc(C(C)NC(=O)Cc2ccc(N)cn2)c1
InChIInChI=1S/C18H23N3O2/c1-12(2)23-17-6-4-5-14(9-17)13(3)21-18(22)10-16-8-7-15(19)11-20-16/h4-9,11-13H,10,19H2,1-3H3,(H,21,22)
InChIKeyLRVIVLSOKFAHQM-UHFFFAOYSA-N
MW313.40 g/mol
LogP2.87
Rot. Bonds6

About 2-(5-amino-2-pyridinyl)-N-[1-(3-propan-2-yloxyphenyl)ethyl]acetamide

2-(5-amino-2-pyridinyl)-N-[1-(3-propan-2-yloxyphenyl)ethyl]acetamide (PubChem CID 120622083) has the molecular formula C18H23N3O2 and a molecular weight of 313.40 g/mol. Its IUPAC name is 2-(5-amino-2-pyridinyl)-N-[1-(3-propan-2-yloxyphenyl)ethyl]acetamide.

Molecular Properties

Compound Name2-(5-amino-2-pyridinyl)-N-[1-(3-propan-2-yloxyphenyl)ethyl]acetamide
PubChem CID120622083
Molecular FormulaC18H23N3O2
Molecular Weight313.40 g/mol
Exact Mass313.18
IUPAC Name2-(5-amino-2-pyridinyl)-N-[1-(3-propan-2-yloxyphenyl)ethyl]acetamide
SMILESCC(C)Oc1cccc(C(C)NC(=O)Cc2ccc(N)cn2)c1
InChIInChI=1S/C18H23N3O2/c1-12(2)23-17-6-4-5-14(9-17)13(3)21-18(22)10-16-8-7-15(19)11-20-16/h4-9,11-13H,10,19H2,1-3H3,(H,21,22)
InChIKeyLRVIVLSOKFAHQM-UHFFFAOYSA-N
XLogP2.87
TPSA77.24 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500313.40
LogP ≤ 52.87
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze 2-(5-amino-2-pyridinyl)-N-[1-(3-propan-2-yloxyphenyl)ethyl]acetamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

2-(5-amino-2-pyridinyl)-N-[1-(3-methoxyphenyl)ethyl]acetamide;hydrochloride
CID 120620251
2-(5-amino-2-pyridinyl)-N-[(1S)-1-(3-fluorophenyl)ethyl]acetamide
CID 107339328
2-(5-amino-2-pyridinyl)-N-[(1S)-1-phenylethyl]acetamide
CID 107338863
2-(5-amino-2-pyridinyl)-N-[1-(3,4-difluorophenyl)ethyl]acetamide
CID 107337738
2-(5-amino-2-pyridinyl)-N-[1-(4-tert-butylphenyl)ethyl]acetamide
CID 120621513
2-(5-amino-2-pyridinyl)-N-[1-(4-propan-2-ylphenyl)ethyl]acetamide;hydrochloride
CID 120617873
2-(methylamino)-N-[1-(3-propan-2-yloxyphenyl)ethyl]acetamide
CID 43705705
2-(5-amino-2-pyridinyl)-N-[1-(2-methylphenyl)ethyl]acetamide
CID 107338393
4-chloro-N-[1-(3-propan-2-yloxyphenyl)ethyl]butanamide
CID 63307817
2-(5-amino-2-pyridinyl)-N-[1-[2-(difluoromethoxy)phenyl]ethyl]acetamide
CID 120621521
6-[[1-(3-propan-2-yloxyphenyl)ethylamino]methyl]pyridin-3-ol
CID 79782484
(2S)-2-[[2-(5-amino-2-pyridinyl)acetyl]amino]propanoic acid
CID 107338226

Frequently Asked Questions

What is the IUPAC name of 2-(5-amino-2-pyridinyl)-N-[1-(3-propan-2-yloxyphenyl)ethyl]acetamide?
The IUPAC name of 2-(5-amino-2-pyridinyl)-N-[1-(3-propan-2-yloxyphenyl)ethyl]acetamide (CID 120622083) is 2-(5-amino-2-pyridinyl)-N-[1-(3-propan-2-yloxyphenyl)ethyl]acetamide.
What is the SMILES notation for 2-(5-amino-2-pyridinyl)-N-[1-(3-propan-2-yloxyphenyl)ethyl]acetamide?
The canonical SMILES for 2-(5-amino-2-pyridinyl)-N-[1-(3-propan-2-yloxyphenyl)ethyl]acetamide is CC(C)Oc1cccc(C(C)NC(=O)Cc2ccc(N)cn2)c1.
What is the InChIKey of 2-(5-amino-2-pyridinyl)-N-[1-(3-propan-2-yloxyphenyl)ethyl]acetamide?
The InChIKey is LRVIVLSOKFAHQM-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H23N3O2/c1-12(2)23-17-6-4-5-14(9-17)13(3)21-18(22)10-16-8-7-15(19)11-20-16/h4-9,11-13H,10,19H2,1-3H3,(H,21,22).
What are the key properties of 2-(5-amino-2-pyridinyl)-N-[1-(3-propan-2-yloxyphenyl)ethyl]acetamide?
2-(5-amino-2-pyridinyl)-N-[1-(3-propan-2-yloxyphenyl)ethyl]acetamide has a molecular weight of 313.40 g/mol, XLogP of 2.87, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(5-amino-2-pyridinyl)-N-[1-(3-propan-2-yloxyphenyl)ethyl]acetamide is sourced from PubChem (CID 120622083), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).