1-(imidazo[1,2-a]pyridin-7-ylmethyl)-3-[[4-(propylamino)phenyl]methyl]urea

C19H23N5O — CID 119049609

IUPAC1-(imidazo[1,2-a]pyridin-7-ylmethyl)-3-[[4-(propylamino)phenyl]methyl]urea
SMILESCCCNc1ccc(CNC(=O)NCc2ccn3ccnc3c2)cc1
InChIInChI=1S/C19H23N5O/c1-2-8-20-17-5-3-15(4-6-17)13-22-19(25)23-14-16-7-10-24-11-9-21-18(24)12-16/h3-7,9-12,20H,2,8,13-14H2,1H3,(H2,22,23,25)
InChIKeyMCTIMCRCQPABQL-UHFFFAOYSA-N
MW337.43 g/mol
LogP3.16
Rot. Bonds7

About 1-(imidazo[1,2-a]pyridin-7-ylmethyl)-3-[[4-(propylamino)phenyl]methyl]urea

1-(imidazo[1,2-a]pyridin-7-ylmethyl)-3-[[4-(propylamino)phenyl]methyl]urea (PubChem CID 119049609) has the molecular formula C19H23N5O and a molecular weight of 337.43 g/mol. Its IUPAC name is 1-(imidazo[1,2-a]pyridin-7-ylmethyl)-3-[[4-(propylamino)phenyl]methyl]urea.

Molecular Properties

Compound Name1-(imidazo[1,2-a]pyridin-7-ylmethyl)-3-[[4-(propylamino)phenyl]methyl]urea
PubChem CID119049609
Molecular FormulaC19H23N5O
Molecular Weight337.43 g/mol
Exact Mass337.19
IUPAC Name1-(imidazo[1,2-a]pyridin-7-ylmethyl)-3-[[4-(propylamino)phenyl]methyl]urea
SMILESCCCNc1ccc(CNC(=O)NCc2ccn3ccnc3c2)cc1
InChIInChI=1S/C19H23N5O/c1-2-8-20-17-5-3-15(4-6-17)13-22-19(25)23-14-16-7-10-24-11-9-21-18(24)12-16/h3-7,9-12,20H,2,8,13-14H2,1H3,(H2,22,23,25)
InChIKeyMCTIMCRCQPABQL-UHFFFAOYSA-N
XLogP3.16
TPSA70.46 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500337.43
LogP ≤ 53.16
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Related Compounds

N-[4-(imidazo[1,2-a]pyridin-7-ylmethylcarbamoylamino)phenyl]-4-methylpentanamide
CID 72699350
N-[4-(imidazo[1,2-a]pyridin-7-ylmethylcarbamoylamino)phenyl]-2-propan-2-yloxyacetamide
CID 72699440
1-(imidazo[1,2-a]pyridin-7-ylmethyl)-3-(3-methyl-1,2-oxazol-5-yl)urea
CID 167772547
3-amino-N-(imidazo[1,2-a]pyridin-7-ylmethyl)propanamide
CID 119889538
1-[4-[1-(2-hydroxy-2-methylpropanoyl)piperidin-4-yl]phenyl]-3-(imidazo[1,2-a]pyridin-7-ylmethyl)urea
CID 72700633
4-[4-(imidazo[1,2-a]pyridin-7-ylmethylcarbamoylamino)phenyl]piperidine-1-carboxylic acid
CID 90015798
methyl 4-[(imidazo[1,2-a]pyridine-7-carbonylamino)methyl]benzoate
CID 175026463
3-amino-N-(imidazo[1,2-a]pyridin-7-ylmethyl)cyclopentane-1-carboxamide
CID 119889498
N-(imidazo[1,2-a]pyridin-7-ylmethyl)-2-(4-methyl-3-oxopiperazin-1-yl)acetamide
CID 127984068
N-(imidazo[1,2-a]pyridin-7-ylmethyl)-1,3-thiazolidine-4-carboxamide
CID 119889546
1-(1,3-dihydro-2-benzofuran-5-yl)-3-[[4-(propylamino)phenyl]methyl]urea
CID 99836325
N-(imidazo[1,2-a]pyridin-7-ylmethyl)-4-(1-propan-2-ylsulfonylazetidin-3-yl)benzamide
CID 86701965

Frequently Asked Questions

What is the IUPAC name of 1-(imidazo[1,2-a]pyridin-7-ylmethyl)-3-[[4-(propylamino)phenyl]methyl]urea?
The IUPAC name of 1-(imidazo[1,2-a]pyridin-7-ylmethyl)-3-[[4-(propylamino)phenyl]methyl]urea (CID 119049609) is 1-(imidazo[1,2-a]pyridin-7-ylmethyl)-3-[[4-(propylamino)phenyl]methyl]urea.
What is the SMILES notation for 1-(imidazo[1,2-a]pyridin-7-ylmethyl)-3-[[4-(propylamino)phenyl]methyl]urea?
The canonical SMILES for 1-(imidazo[1,2-a]pyridin-7-ylmethyl)-3-[[4-(propylamino)phenyl]methyl]urea is CCCNc1ccc(CNC(=O)NCc2ccn3ccnc3c2)cc1.
What is the InChIKey of 1-(imidazo[1,2-a]pyridin-7-ylmethyl)-3-[[4-(propylamino)phenyl]methyl]urea?
The InChIKey is MCTIMCRCQPABQL-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H23N5O/c1-2-8-20-17-5-3-15(4-6-17)13-22-19(25)23-14-16-7-10-24-11-9-21-18(24)12-16/h3-7,9-12,20H,2,8,13-14H2,1H3,(H2,22,23,25).
What are the key properties of 1-(imidazo[1,2-a]pyridin-7-ylmethyl)-3-[[4-(propylamino)phenyl]methyl]urea?
1-(imidazo[1,2-a]pyridin-7-ylmethyl)-3-[[4-(propylamino)phenyl]methyl]urea has a molecular weight of 337.43 g/mol, XLogP of 3.16, 7 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(imidazo[1,2-a]pyridin-7-ylmethyl)-3-[[4-(propylamino)phenyl]methyl]urea is sourced from PubChem (CID 119049609), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).