1-[(2S)-1-methoxypropan-2-yl]-3-[(6-morpholin-4-yl-3-pyridinyl)methyl]urea

C15H24N4O3 — CID 34669155

IUPAC1-[(2S)-1-methoxypropan-2-yl]-3-[(6-morpholin-4-yl-3-pyridinyl)methyl]urea
SMILESCOC[C@H](C)NC(=O)NCc1ccc(N2CCOCC2)nc1
InChIInChI=1S/C15H24N4O3/c1-12(11-21-2)18-15(20)17-10-13-3-4-14(16-9-13)19-5-7-22-8-6-19/h3-4,9,12H,5-8,10-11H2,1-2H3,(H2,17,18,20)/t12-/m0/s1
InChIKeyFGRUKLCFTQOSSI-LBPRGKRZSA-N
MW308.38 g/mol
LogP0.75
Rot. Bonds6

About 1-[(2S)-1-methoxypropan-2-yl]-3-[(6-morpholin-4-yl-3-pyridinyl)methyl]urea

1-[(2S)-1-methoxypropan-2-yl]-3-[(6-morpholin-4-yl-3-pyridinyl)methyl]urea (PubChem CID 34669155) has the molecular formula C15H24N4O3 and a molecular weight of 308.38 g/mol. Its IUPAC name is 1-[(2S)-1-methoxypropan-2-yl]-3-[(6-morpholin-4-yl-3-pyridinyl)methyl]urea.

Molecular Properties

Compound Name1-[(2S)-1-methoxypropan-2-yl]-3-[(6-morpholin-4-yl-3-pyridinyl)methyl]urea
PubChem CID34669155
Molecular FormulaC15H24N4O3
Molecular Weight308.38 g/mol
Exact Mass308.18
IUPAC Name1-[(2S)-1-methoxypropan-2-yl]-3-[(6-morpholin-4-yl-3-pyridinyl)methyl]urea
SMILESCOC[C@H](C)NC(=O)NCc1ccc(N2CCOCC2)nc1
InChIInChI=1S/C15H24N4O3/c1-12(11-21-2)18-15(20)17-10-13-3-4-14(16-9-13)19-5-7-22-8-6-19/h3-4,9,12H,5-8,10-11H2,1-2H3,(H2,17,18,20)/t12-/m0/s1
InChIKeyFGRUKLCFTQOSSI-LBPRGKRZSA-N
XLogP0.75
TPSA75.72 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500308.38
LogP ≤ 50.75
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Analyze 1-[(2S)-1-methoxypropan-2-yl]-3-[(6-morpholin-4-yl-3-pyridinyl)methyl]urea with MolForge

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Related Compounds

2-methoxy-N-[(6-morpholin-4-yl-3-pyridinyl)methyl]propanamide
CID 47303387
2-methyl-3-[(6-morpholin-4-yl-3-pyridinyl)methylamino]-3-oxopropanoic acid
CID 114897147
3-chloro-2-methyl-N-[(6-morpholin-4-yl-3-pyridinyl)methyl]propanamide
CID 62727165
1-(2-ethyl-1-phenylbutyl)-3-[(6-morpholin-4-yl-3-pyridinyl)methyl]urea
CID 42962719
4-(2-methylpropoxy)-N-[(6-morpholin-4-yl-3-pyridinyl)methyl]benzamide
CID 16602299
1-(2-methoxyphenyl)-3-[(6-morpholin-4-yl-3-pyridinyl)methyl]urea
CID 41430289
1-(6-methoxy-3-pyridinyl)-3-[(6-morpholin-4-yl-3-pyridinyl)methyl]urea
CID 51078466
tert-butyl N-[(6-morpholin-4-yl-3-pyridinyl)methyl]carbamate
CID 63787976
N-[(6-morpholin-4-yl-3-pyridinyl)methyl]-2-phenoxypropanamide
CID 18145200
1-[[4-(2,5-dihydropyrrol-1-yl)phenyl]methyl]-3-[(2R)-1-methoxypropan-2-yl]urea
CID 98184642
(1R)-2,2-dichloro-1-methyl-N-[(6-morpholin-4-yl-3-pyridinyl)methyl]cyclopropane-1-carboxamide
CID 42473931
2-[(4-fluorophenyl)methylcarbamoylamino]-N-[(6-morpholin-4-yl-3-pyridinyl)methyl]pentanamide
CID 24613316

Frequently Asked Questions

What is the IUPAC name of 1-[(2S)-1-methoxypropan-2-yl]-3-[(6-morpholin-4-yl-3-pyridinyl)methyl]urea?
The IUPAC name of 1-[(2S)-1-methoxypropan-2-yl]-3-[(6-morpholin-4-yl-3-pyridinyl)methyl]urea (CID 34669155) is 1-[(2S)-1-methoxypropan-2-yl]-3-[(6-morpholin-4-yl-3-pyridinyl)methyl]urea.
What is the SMILES notation for 1-[(2S)-1-methoxypropan-2-yl]-3-[(6-morpholin-4-yl-3-pyridinyl)methyl]urea?
The canonical SMILES for 1-[(2S)-1-methoxypropan-2-yl]-3-[(6-morpholin-4-yl-3-pyridinyl)methyl]urea is COC[C@H](C)NC(=O)NCc1ccc(N2CCOCC2)nc1.
What is the InChIKey of 1-[(2S)-1-methoxypropan-2-yl]-3-[(6-morpholin-4-yl-3-pyridinyl)methyl]urea?
The InChIKey is FGRUKLCFTQOSSI-LBPRGKRZSA-N. The full InChI is InChI=1S/C15H24N4O3/c1-12(11-21-2)18-15(20)17-10-13-3-4-14(16-9-13)19-5-7-22-8-6-19/h3-4,9,12H,5-8,10-11H2,1-2H3,(H2,17,18,20)/t12-/m0/s1.
What are the key properties of 1-[(2S)-1-methoxypropan-2-yl]-3-[(6-morpholin-4-yl-3-pyridinyl)methyl]urea?
1-[(2S)-1-methoxypropan-2-yl]-3-[(6-morpholin-4-yl-3-pyridinyl)methyl]urea has a molecular weight of 308.38 g/mol, XLogP of 0.75, 6 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[(2S)-1-methoxypropan-2-yl]-3-[(6-morpholin-4-yl-3-pyridinyl)methyl]urea is sourced from PubChem (CID 34669155), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).