N-[1-[(2R,5R)-2,5-dimethylpiperidin-1-yl]propan-2-yl]-N-pyridin-2-ylpropanamide

C18H29N3O — CID 24843226

IUPACN-[1-[(2R,5R)-2,5-dimethylpiperidin-1-yl]propan-2-yl]-N-pyridin-2-ylpropanamide
SMILESCCC(=O)N(c1ccccn1)C(C)CN1C[C@H](C)CC[C@H]1C
InChIInChI=1S/C18H29N3O/c1-5-18(22)21(17-8-6-7-11-19-17)16(4)13-20-12-14(2)9-10-15(20)3/h6-8,11,14-16H,5,9-10,12-13H2,1-4H3/t14-,15-,16?/m1/s1
InChIKeyQXOSVXKJXLKWDO-YGFGXBMJSA-N
MW303.45 g/mol
LogP3.33
Rot. Bonds5

About N-[1-[(2R,5R)-2,5-dimethylpiperidin-1-yl]propan-2-yl]-N-pyridin-2-ylpropanamide

N-[1-[(2R,5R)-2,5-dimethylpiperidin-1-yl]propan-2-yl]-N-pyridin-2-ylpropanamide (PubChem CID 24843226) has the molecular formula C18H29N3O and a molecular weight of 303.45 g/mol. Its IUPAC name is N-[1-[(2R,5R)-2,5-dimethylpiperidin-1-yl]propan-2-yl]-N-pyridin-2-ylpropanamide.

Molecular Properties

Compound NameN-[1-[(2R,5R)-2,5-dimethylpiperidin-1-yl]propan-2-yl]-N-pyridin-2-ylpropanamide
PubChem CID24843226
Molecular FormulaC18H29N3O
Molecular Weight303.45 g/mol
Exact Mass303.23
IUPAC NameN-[1-[(2R,5R)-2,5-dimethylpiperidin-1-yl]propan-2-yl]-N-pyridin-2-ylpropanamide
SMILESCCC(=O)N(c1ccccn1)C(C)CN1C[C@H](C)CC[C@H]1C
InChIInChI=1S/C18H29N3O/c1-5-18(22)21(17-8-6-7-11-19-17)16(4)13-20-12-14(2)9-10-15(20)3/h6-8,11,14-16H,5,9-10,12-13H2,1-4H3/t14-,15-,16?/m1/s1
InChIKeyQXOSVXKJXLKWDO-YGFGXBMJSA-N
XLogP3.33
TPSA36.44 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500303.45
LogP ≤ 53.33
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

N-[1-(3,3-dimethylazepan-1-yl)propan-2-yl]-N-pyridin-2-ylpropanamide
CID 3041491
N-[1-(2,2-dimethylazepan-1-yl)propan-2-yl]-N-pyridin-2-ylpropanamide
CID 3041490
N-(1-iodo-3-piperidin-1-ylpropan-2-yl)-N-pyridin-2-ylpropanamide
CID 170437756
N-(2-piperidin-1-ylpropyl)-N-pyridin-2-ylpropanamide
CID 3041469
ethyl 4-[methyl(pyridin-2-yl)amino]cyclohexane-1-carboxylate
CID 115149187
N-cyclopropyl-N-pyridin-2-ylpentanamide
CID 110723068
N-pentan-2-yl-N-(4-propylpyrimidin-2-yl)propanamide
CID 142120097
N-methyl-3-(propan-2-ylamino)-N-pyridin-2-ylpropanamide
CID 60852882
N-[1-(2-amino-3,4-dioxocyclobuten-1-yl)piperidin-4-yl]-N-pyridin-2-ylpropanamide
CID 134069498
N-[1-[4-(2-methoxyphenyl)piperazin-1-yl]propan-2-yl]-N-pyridin-2-ylcyclohexanecarboxamide
CID 609668
1-benzyl-2,5-dimethylpiperidine
CID 73200484
2-(dipyridin-2-ylamino)propanoic acid
CID 138338502

Frequently Asked Questions

What is the IUPAC name of N-[1-[(2R,5R)-2,5-dimethylpiperidin-1-yl]propan-2-yl]-N-pyridin-2-ylpropanamide?
The IUPAC name of N-[1-[(2R,5R)-2,5-dimethylpiperidin-1-yl]propan-2-yl]-N-pyridin-2-ylpropanamide (CID 24843226) is N-[1-[(2R,5R)-2,5-dimethylpiperidin-1-yl]propan-2-yl]-N-pyridin-2-ylpropanamide.
What is the SMILES notation for N-[1-[(2R,5R)-2,5-dimethylpiperidin-1-yl]propan-2-yl]-N-pyridin-2-ylpropanamide?
The canonical SMILES for N-[1-[(2R,5R)-2,5-dimethylpiperidin-1-yl]propan-2-yl]-N-pyridin-2-ylpropanamide is CCC(=O)N(c1ccccn1)C(C)CN1C[C@H](C)CC[C@H]1C.
What is the InChIKey of N-[1-[(2R,5R)-2,5-dimethylpiperidin-1-yl]propan-2-yl]-N-pyridin-2-ylpropanamide?
The InChIKey is QXOSVXKJXLKWDO-YGFGXBMJSA-N. The full InChI is InChI=1S/C18H29N3O/c1-5-18(22)21(17-8-6-7-11-19-17)16(4)13-20-12-14(2)9-10-15(20)3/h6-8,11,14-16H,5,9-10,12-13H2,1-4H3/t14-,15-,16?/m1/s1.
What are the key properties of N-[1-[(2R,5R)-2,5-dimethylpiperidin-1-yl]propan-2-yl]-N-pyridin-2-ylpropanamide?
N-[1-[(2R,5R)-2,5-dimethylpiperidin-1-yl]propan-2-yl]-N-pyridin-2-ylpropanamide has a molecular weight of 303.45 g/mol, XLogP of 3.33, 5 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-[(2R,5R)-2,5-dimethylpiperidin-1-yl]propan-2-yl]-N-pyridin-2-ylpropanamide is sourced from PubChem (CID 24843226), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).