(3R)-3-(carbamoylamino)-N-(6-morpholin-4-yl-3-pyridinyl)-3-(3-phenoxyphenyl)propanamide

C25H27N5O4 — CID 34444234

IUPAC(3R)-3-(carbamoylamino)-N-(6-morpholin-4-yl-3-pyridinyl)-3-(3-phenoxyphenyl)propanamide
SMILESNC(=O)N[C@H](CC(=O)Nc1ccc(N2CCOCC2)nc1)c1cccc(Oc2ccccc2)c1
InChIInChI=1S/C25H27N5O4/c26-25(32)29-22(18-5-4-8-21(15-18)34-20-6-2-1-3-7-20)16-24(31)28-19-9-10-23(27-17-19)30-11-13-33-14-12-30/h1-10,15,17,22H,11-14,16H2,(H,28,31)(H3,26,29,32)/t22-/m1/s1
InChIKeyZWJWZIOMXKAXQL-JOCHJYFZSA-N
MW461.52 g/mol
LogP3.45
Rot. Bonds8

About (3R)-3-(carbamoylamino)-N-(6-morpholin-4-yl-3-pyridinyl)-3-(3-phenoxyphenyl)propanamide

(3R)-3-(carbamoylamino)-N-(6-morpholin-4-yl-3-pyridinyl)-3-(3-phenoxyphenyl)propanamide (PubChem CID 34444234) has the molecular formula C25H27N5O4 and a molecular weight of 461.52 g/mol. Its IUPAC name is (3R)-3-(carbamoylamino)-N-(6-morpholin-4-yl-3-pyridinyl)-3-(3-phenoxyphenyl)propanamide.

Molecular Properties

Compound Name(3R)-3-(carbamoylamino)-N-(6-morpholin-4-yl-3-pyridinyl)-3-(3-phenoxyphenyl)propanamide
PubChem CID34444234
Molecular FormulaC25H27N5O4
Molecular Weight461.52 g/mol
Exact Mass461.21
IUPAC Name(3R)-3-(carbamoylamino)-N-(6-morpholin-4-yl-3-pyridinyl)-3-(3-phenoxyphenyl)propanamide
SMILESNC(=O)N[C@H](CC(=O)Nc1ccc(N2CCOCC2)nc1)c1cccc(Oc2ccccc2)c1
InChIInChI=1S/C25H27N5O4/c26-25(32)29-22(18-5-4-8-21(15-18)34-20-6-2-1-3-7-20)16-24(31)28-19-9-10-23(27-17-19)30-11-13-33-14-12-30/h1-10,15,17,22H,11-14,16H2,(H,28,31)(H3,26,29,32)/t22-/m1/s1
InChIKeyZWJWZIOMXKAXQL-JOCHJYFZSA-N
XLogP3.45
TPSA118.81 Ų
H-Bond Donors3
H-Bond Acceptors6
Rotatable Bonds8
Heavy Atoms34
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500461.52
LogP ≤ 53.45
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 106

Analyze (3R)-3-(carbamoylamino)-N-(6-morpholin-4-yl-3-pyridinyl)-3-(3-phenoxyphenyl)propanamide 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

N-(6-anilino-3-pyridinyl)-3-(carbamoylamino)-3-(3-phenoxyphenyl)propanamide
CID 146152381
3-(carbamoylamino)-N-(6-morpholin-4-yl-3-pyridinyl)-3-thiophen-2-ylpropanamide
CID 55501306
3-(carbamoylamino)-N-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-3-(3-phenoxyphenyl)propanamide
CID 4797821
(3R)-3-(carbamoylamino)-N-(4-ethylphenyl)-3-(3-phenoxyphenyl)propanamide
CID 9213620
(3R)-3-(carbamoylamino)-N-[4-(2-oxopyrrolidin-1-yl)phenyl]-3-(3-phenoxyphenyl)propanamide
CID 34192223
2-benzhydrylsulfanyl-N-(6-morpholin-4-yl-3-pyridinyl)acetamide
CID 24590429
(3R)-3-(carbamoylamino)-N-(3-chlorophenyl)-3-(3-phenoxyphenyl)propanamide
CID 9412253
3-(carbamoylamino)-N-(2-methyl-1,3-benzoxazol-5-yl)-3-(3-phenoxyphenyl)propanamide
CID 85484955
(3R)-3-(carbamoylamino)-3-(3-phenoxyphenyl)-N-piperidin-1-ylpropanamide
CID 9271549
3-[(6-morpholin-4-yl-3-pyridinyl)amino]-3-oxopropanoic acid
CID 62229953
(3S)-3-(carbamoylamino)-N-(3-methylsulfanylphenyl)-3-(3-phenoxyphenyl)propanamide
CID 9402974
6-morpholin-4-yl-N-(4-phenoxyphenyl)pyridine-3-carboxamide
CID 109153445

Frequently Asked Questions

What is the IUPAC name of (3R)-3-(carbamoylamino)-N-(6-morpholin-4-yl-3-pyridinyl)-3-(3-phenoxyphenyl)propanamide?
The IUPAC name of (3R)-3-(carbamoylamino)-N-(6-morpholin-4-yl-3-pyridinyl)-3-(3-phenoxyphenyl)propanamide (CID 34444234) is (3R)-3-(carbamoylamino)-N-(6-morpholin-4-yl-3-pyridinyl)-3-(3-phenoxyphenyl)propanamide.
What is the SMILES notation for (3R)-3-(carbamoylamino)-N-(6-morpholin-4-yl-3-pyridinyl)-3-(3-phenoxyphenyl)propanamide?
The canonical SMILES for (3R)-3-(carbamoylamino)-N-(6-morpholin-4-yl-3-pyridinyl)-3-(3-phenoxyphenyl)propanamide is NC(=O)N[C@H](CC(=O)Nc1ccc(N2CCOCC2)nc1)c1cccc(Oc2ccccc2)c1.
What is the InChIKey of (3R)-3-(carbamoylamino)-N-(6-morpholin-4-yl-3-pyridinyl)-3-(3-phenoxyphenyl)propanamide?
The InChIKey is ZWJWZIOMXKAXQL-JOCHJYFZSA-N. The full InChI is InChI=1S/C25H27N5O4/c26-25(32)29-22(18-5-4-8-21(15-18)34-20-6-2-1-3-7-20)16-24(31)28-19-9-10-23(27-17-19)30-11-13-33-14-12-30/h1-10,15,17,22H,11-14,16H2,(H,28,31)(H3,26,29,32)/t22-/m1/s1.
What are the key properties of (3R)-3-(carbamoylamino)-N-(6-morpholin-4-yl-3-pyridinyl)-3-(3-phenoxyphenyl)propanamide?
(3R)-3-(carbamoylamino)-N-(6-morpholin-4-yl-3-pyridinyl)-3-(3-phenoxyphenyl)propanamide has a molecular weight of 461.52 g/mol, XLogP of 3.45, 8 rotatable bonds, 3 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for (3R)-3-(carbamoylamino)-N-(6-morpholin-4-yl-3-pyridinyl)-3-(3-phenoxyphenyl)propanamide is sourced from PubChem (CID 34444234), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).