2,2-dimethyl-N-[5-methyl-4-(morpholin-4-ylmethyl)-2-pyridinyl]propanamide

C16H25N3O2 — CID 45487771

IUPAC2,2-dimethyl-N-[5-methyl-4-(morpholin-4-ylmethyl)-2-pyridinyl]propanamide
SMILESCc1cnc(NC(=O)C(C)(C)C)cc1CN1CCOCC1
InChIInChI=1S/C16H25N3O2/c1-12-10-17-14(18-15(20)16(2,3)4)9-13(12)11-19-5-7-21-8-6-19/h9-10H,5-8,11H2,1-4H3,(H,17,18,20)
InChIKeyQJLZKNFBWRBWEU-UHFFFAOYSA-N
MW291.39 g/mol
LogP2.21
Rot. Bonds3

About 2,2-dimethyl-N-[5-methyl-4-(morpholin-4-ylmethyl)-2-pyridinyl]propanamide

2,2-dimethyl-N-[5-methyl-4-(morpholin-4-ylmethyl)-2-pyridinyl]propanamide (PubChem CID 45487771) has the molecular formula C16H25N3O2 and a molecular weight of 291.39 g/mol. Its IUPAC name is 2,2-dimethyl-N-[5-methyl-4-(morpholin-4-ylmethyl)-2-pyridinyl]propanamide.

Molecular Properties

Compound Name2,2-dimethyl-N-[5-methyl-4-(morpholin-4-ylmethyl)-2-pyridinyl]propanamide
PubChem CID45487771
Molecular FormulaC16H25N3O2
Molecular Weight291.39 g/mol
Exact Mass291.19
IUPAC Name2,2-dimethyl-N-[5-methyl-4-(morpholin-4-ylmethyl)-2-pyridinyl]propanamide
SMILESCc1cnc(NC(=O)C(C)(C)C)cc1CN1CCOCC1
InChIInChI=1S/C16H25N3O2/c1-12-10-17-14(18-15(20)16(2,3)4)9-13(12)11-19-5-7-21-8-6-19/h9-10H,5-8,11H2,1-4H3,(H,17,18,20)
InChIKeyQJLZKNFBWRBWEU-UHFFFAOYSA-N
XLogP2.21
TPSA54.46 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500291.39
LogP ≤ 52.21
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

Ethyl 4-[(4-methylpyridin-2-yl)amino]piperidine-1-carboxylate
CID 11149707
2-(Pivaloylamino)pyridine
CID 1051519
(3S,5R)-5-N-cyclopropyl-3-N-[(2R)-1-ethoxy-4-methylpentan-2-yl]-5-N-(5-propan-2-yl-2-pyridinyl)piperidine-3,5-dicarboxamide
CID 25222059
2-Acetylamino-3,3,3-trifluoro-2-(5-methyl-pyridin-2-ylamino)-propionic acid methyl ester
CID 609233
Methyl 2-acetamido-3,3,3-trifluoro-2-[(4-methylpyridin-2-yl)amino]propanoate
CID 3598834
2-Methoxy-1-(2-pyridin-2-yl-2,9-diazaspiro[5.5]undecan-9-yl)ethanone
CID 3233036
(3S,5R)-5-N-cyclopropyl-3-N-[(2R)-1-ethoxy-4-methylpentan-2-yl]-5-N-(5-propan-2-yl-2-pyridinyl)piperidine-3,5-dicarboxamide;hydrochloride
CID 118709230
N-benzyl-2,2-dimethyl-N-(pyridin-2-yl)propanamide
CID 1122454
N,N'-bis(5-methylpyridin-2-yl)ethanediamide
CID 2166281
ethyl 3,3,3-trifluoro-2-[(5-methylpyridin-2-yl)amino]-N-pentanoylalaninate
CID 659845
3-methoxy-N-(4-(2-(phenylamino)pyridin-4-yl)pyridin-2-yl)propanamide
CID 10472936
2,2-dimethyl-N-(5-methyl-4-(morpholinomethyl)pyridin-2-yl)butanamide
CID 24884489

Frequently Asked Questions

What is the IUPAC name of 2,2-dimethyl-N-[5-methyl-4-(morpholin-4-ylmethyl)-2-pyridinyl]propanamide?
The IUPAC name of 2,2-dimethyl-N-[5-methyl-4-(morpholin-4-ylmethyl)-2-pyridinyl]propanamide (CID 45487771) is 2,2-dimethyl-N-[5-methyl-4-(morpholin-4-ylmethyl)-2-pyridinyl]propanamide.
What is the SMILES notation for 2,2-dimethyl-N-[5-methyl-4-(morpholin-4-ylmethyl)-2-pyridinyl]propanamide?
The canonical SMILES for 2,2-dimethyl-N-[5-methyl-4-(morpholin-4-ylmethyl)-2-pyridinyl]propanamide is Cc1cnc(NC(=O)C(C)(C)C)cc1CN1CCOCC1.
What is the InChIKey of 2,2-dimethyl-N-[5-methyl-4-(morpholin-4-ylmethyl)-2-pyridinyl]propanamide?
The InChIKey is QJLZKNFBWRBWEU-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H25N3O2/c1-12-10-17-14(18-15(20)16(2,3)4)9-13(12)11-19-5-7-21-8-6-19/h9-10H,5-8,11H2,1-4H3,(H,17,18,20).
What are the key properties of 2,2-dimethyl-N-[5-methyl-4-(morpholin-4-ylmethyl)-2-pyridinyl]propanamide?
2,2-dimethyl-N-[5-methyl-4-(morpholin-4-ylmethyl)-2-pyridinyl]propanamide has a molecular weight of 291.39 g/mol, XLogP of 2.21, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2,2-dimethyl-N-[5-methyl-4-(morpholin-4-ylmethyl)-2-pyridinyl]propanamide is sourced from PubChem (CID 45487771), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).