N-[4-(imidazo[1,2-a]pyridin-7-ylmethylcarbamoylamino)phenyl]-2-propan-2-yloxyacetamide

C20H23N5O3 — CID 72699440

IUPACN-[4-(imidazo[1,2-a]pyridin-7-ylmethylcarbamoylamino)phenyl]-2-propan-2-yloxyacetamide
SMILESCC(C)OCC(=O)Nc1ccc(NC(=O)NCc2ccn3ccnc3c2)cc1
InChIInChI=1S/C20H23N5O3/c1-14(2)28-13-19(26)23-16-3-5-17(6-4-16)24-20(27)22-12-15-7-9-25-10-8-21-18(25)11-15/h3-11,14H,12-13H2,1-2H3,(H,23,26)(H2,22,24,27)
InChIKeyMWRYDGKNXZOSPO-UHFFFAOYSA-N
MW381.44 g/mol
LogP3.02
Rot. Bonds7

About N-[4-(imidazo[1,2-a]pyridin-7-ylmethylcarbamoylamino)phenyl]-2-propan-2-yloxyacetamide

N-[4-(imidazo[1,2-a]pyridin-7-ylmethylcarbamoylamino)phenyl]-2-propan-2-yloxyacetamide (PubChem CID 72699440) has the molecular formula C20H23N5O3 and a molecular weight of 381.44 g/mol. Its IUPAC name is N-[4-(imidazo[1,2-a]pyridin-7-ylmethylcarbamoylamino)phenyl]-2-propan-2-yloxyacetamide.

Molecular Properties

Compound NameN-[4-(imidazo[1,2-a]pyridin-7-ylmethylcarbamoylamino)phenyl]-2-propan-2-yloxyacetamide
PubChem CID72699440
Molecular FormulaC20H23N5O3
Molecular Weight381.44 g/mol
Exact Mass381.18
IUPAC NameN-[4-(imidazo[1,2-a]pyridin-7-ylmethylcarbamoylamino)phenyl]-2-propan-2-yloxyacetamide
SMILESCC(C)OCC(=O)Nc1ccc(NC(=O)NCc2ccn3ccnc3c2)cc1
InChIInChI=1S/C20H23N5O3/c1-14(2)28-13-19(26)23-16-3-5-17(6-4-16)24-20(27)22-12-15-7-9-25-10-8-21-18(25)11-15/h3-11,14H,12-13H2,1-2H3,(H,23,26)(H2,22,24,27)
InChIKeyMWRYDGKNXZOSPO-UHFFFAOYSA-N
XLogP3.02
TPSA96.76 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500381.44
LogP ≤ 53.02
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

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Related Compounds

N-[4-(imidazo[1,2-a]pyridin-7-ylmethylcarbamoylamino)phenyl]-4-methylpentanamide
CID 72699350
1-[4-[1-(2-hydroxy-2-methylpropanoyl)piperidin-4-yl]phenyl]-3-(imidazo[1,2-a]pyridin-7-ylmethyl)urea
CID 72700633
1-(imidazo[1,2-a]pyridin-7-ylmethyl)-3-(3-methyl-1,2-oxazol-5-yl)urea
CID 167772547
4-[4-(imidazo[1,2-a]pyridin-7-ylmethylcarbamoylamino)phenyl]piperidine-1-carboxylic acid
CID 90015798
1-(imidazo[1,2-a]pyridin-7-ylmethyl)-3-[[4-(propylamino)phenyl]methyl]urea
CID 119049609
3-amino-N-(imidazo[1,2-a]pyridin-7-ylmethyl)propanamide
CID 119889538
N-[(4-acetamidophenyl)methyl]-2-propan-2-yloxyacetamide
CID 47412659
N-[4-(chloromethyl)phenyl]-2-propan-2-yloxyacetamide
CID 112604074
1-(imidazo[1,2-a]pyridin-7-ylmethyl)-3-[4-[1-(isoquinoline-4-carbonyl)piperidin-4-yl]phenyl]urea
CID 72699869
(2S)-2-amino-3-imidazo[1,2-a]pyridin-7-ylpropanoic acid
CID 96765274
N-[4-(3-methyl-2-oxobutyl)phenyl]-2-propan-2-yloxyacetamide
CID 176753674
ethyl N-[4-[(2-propan-2-yloxyacetyl)amino]phenyl]carbamate
CID 47413009

Frequently Asked Questions

What is the IUPAC name of N-[4-(imidazo[1,2-a]pyridin-7-ylmethylcarbamoylamino)phenyl]-2-propan-2-yloxyacetamide?
The IUPAC name of N-[4-(imidazo[1,2-a]pyridin-7-ylmethylcarbamoylamino)phenyl]-2-propan-2-yloxyacetamide (CID 72699440) is N-[4-(imidazo[1,2-a]pyridin-7-ylmethylcarbamoylamino)phenyl]-2-propan-2-yloxyacetamide.
What is the SMILES notation for N-[4-(imidazo[1,2-a]pyridin-7-ylmethylcarbamoylamino)phenyl]-2-propan-2-yloxyacetamide?
The canonical SMILES for N-[4-(imidazo[1,2-a]pyridin-7-ylmethylcarbamoylamino)phenyl]-2-propan-2-yloxyacetamide is CC(C)OCC(=O)Nc1ccc(NC(=O)NCc2ccn3ccnc3c2)cc1.
What is the InChIKey of N-[4-(imidazo[1,2-a]pyridin-7-ylmethylcarbamoylamino)phenyl]-2-propan-2-yloxyacetamide?
The InChIKey is MWRYDGKNXZOSPO-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H23N5O3/c1-14(2)28-13-19(26)23-16-3-5-17(6-4-16)24-20(27)22-12-15-7-9-25-10-8-21-18(25)11-15/h3-11,14H,12-13H2,1-2H3,(H,23,26)(H2,22,24,27).
What are the key properties of N-[4-(imidazo[1,2-a]pyridin-7-ylmethylcarbamoylamino)phenyl]-2-propan-2-yloxyacetamide?
N-[4-(imidazo[1,2-a]pyridin-7-ylmethylcarbamoylamino)phenyl]-2-propan-2-yloxyacetamide has a molecular weight of 381.44 g/mol, XLogP of 3.02, 7 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-(imidazo[1,2-a]pyridin-7-ylmethylcarbamoylamino)phenyl]-2-propan-2-yloxyacetamide is sourced from PubChem (CID 72699440), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).