2-(carbamoylamino)-3-methyl-N-(6-morpholin-4-yl-3-pyridinyl)pentanamide

C16H25N5O3 — CID 43044640

IUPAC2-(carbamoylamino)-3-methyl-N-(6-morpholin-4-yl-3-pyridinyl)pentanamide
SMILESCCC(C)C(NC(N)=O)C(=O)Nc1ccc(N2CCOCC2)nc1
InChIInChI=1S/C16H25N5O3/c1-3-11(2)14(20-16(17)23)15(22)19-12-4-5-13(18-10-12)21-6-8-24-9-7-21/h4-5,10-11,14H,3,6-9H2,1-2H3,(H,19,22)(H3,17,20,23)
InChIKeyYFXSDDMTIPJASI-UHFFFAOYSA-N
MW335.41 g/mol
LogP0.94
Rot. Bonds6

About 2-(carbamoylamino)-3-methyl-N-(6-morpholin-4-yl-3-pyridinyl)pentanamide

2-(carbamoylamino)-3-methyl-N-(6-morpholin-4-yl-3-pyridinyl)pentanamide (PubChem CID 43044640) has the molecular formula C16H25N5O3 and a molecular weight of 335.41 g/mol. Its IUPAC name is 2-(carbamoylamino)-3-methyl-N-(6-morpholin-4-yl-3-pyridinyl)pentanamide.

Molecular Properties

Compound Name2-(carbamoylamino)-3-methyl-N-(6-morpholin-4-yl-3-pyridinyl)pentanamide
PubChem CID43044640
Molecular FormulaC16H25N5O3
Molecular Weight335.41 g/mol
Exact Mass335.20
IUPAC Name2-(carbamoylamino)-3-methyl-N-(6-morpholin-4-yl-3-pyridinyl)pentanamide
SMILESCCC(C)C(NC(N)=O)C(=O)Nc1ccc(N2CCOCC2)nc1
InChIInChI=1S/C16H25N5O3/c1-3-11(2)14(20-16(17)23)15(22)19-12-4-5-13(18-10-12)21-6-8-24-9-7-21/h4-5,10-11,14H,3,6-9H2,1-2H3,(H,19,22)(H3,17,20,23)
InChIKeyYFXSDDMTIPJASI-UHFFFAOYSA-N
XLogP0.94
TPSA109.58 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500335.41
LogP ≤ 50.94
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

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Related Compounds

2-(carbamoylamino)-N-(6-morpholin-4-yl-3-pyridinyl)propanamide
CID 43044639
(2S)-2-amino-N-(6-morpholin-4-yl-3-pyridinyl)butanamide;dihydrochloride
CID 119839706
(2S)-2-amino-3-methyl-N-(6-morpholin-4-yl-3-pyridinyl)butanamide
CID 61180630
N-(6-morpholin-4-yl-3-pyridinyl)-2-phenylbutanamide
CID 42940174
N-[(2R,3S)-3-methyl-1-[[6-(4-methylpiperazin-1-yl)-3-pyridinyl]amino]-1-oxopentan-2-yl]benzamide
CID 25484039
(2S)-2-[(4-methoxyphenyl)sulfonylamino]-3-methyl-N-(6-morpholin-4-yl-3-pyridinyl)butanamide
CID 30770667
1-(2-hydroxypropyl)-3-(6-morpholin-4-yl-3-pyridinyl)urea
CID 47221090
2-(4-bromophenoxy)-N-(6-morpholin-4-yl-3-pyridinyl)propanamide
CID 24590426
1-methyl-3-(6-morpholin-4-yl-3-pyridinyl)urea
CID 47162241
N-[1-[[6-(2,6-dimethylmorpholin-4-yl)-3-pyridinyl]amino]-3-methyl-1-oxopentan-2-yl]benzamide
CID 55786036
3-(carbamoylamino)-N-(6-morpholin-4-yl-3-pyridinyl)-3-thiophen-2-ylpropanamide
CID 55501306
3-[(6-morpholin-4-yl-3-pyridinyl)amino]-3-oxopropanoic acid
CID 62229953

Frequently Asked Questions

What is the IUPAC name of 2-(carbamoylamino)-3-methyl-N-(6-morpholin-4-yl-3-pyridinyl)pentanamide?
The IUPAC name of 2-(carbamoylamino)-3-methyl-N-(6-morpholin-4-yl-3-pyridinyl)pentanamide (CID 43044640) is 2-(carbamoylamino)-3-methyl-N-(6-morpholin-4-yl-3-pyridinyl)pentanamide.
What is the SMILES notation for 2-(carbamoylamino)-3-methyl-N-(6-morpholin-4-yl-3-pyridinyl)pentanamide?
The canonical SMILES for 2-(carbamoylamino)-3-methyl-N-(6-morpholin-4-yl-3-pyridinyl)pentanamide is CCC(C)C(NC(N)=O)C(=O)Nc1ccc(N2CCOCC2)nc1.
What is the InChIKey of 2-(carbamoylamino)-3-methyl-N-(6-morpholin-4-yl-3-pyridinyl)pentanamide?
The InChIKey is YFXSDDMTIPJASI-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H25N5O3/c1-3-11(2)14(20-16(17)23)15(22)19-12-4-5-13(18-10-12)21-6-8-24-9-7-21/h4-5,10-11,14H,3,6-9H2,1-2H3,(H,19,22)(H3,17,20,23).
What are the key properties of 2-(carbamoylamino)-3-methyl-N-(6-morpholin-4-yl-3-pyridinyl)pentanamide?
2-(carbamoylamino)-3-methyl-N-(6-morpholin-4-yl-3-pyridinyl)pentanamide has a molecular weight of 335.41 g/mol, XLogP of 0.94, 6 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(carbamoylamino)-3-methyl-N-(6-morpholin-4-yl-3-pyridinyl)pentanamide is sourced from PubChem (CID 43044640), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).