N-cyclopropyl-6-[4-(2,6-dimethylphenoxy)piperidin-1-yl]pyridine-3-carboxamide

C22H27N3O2 — CID 71891796

IUPACN-cyclopropyl-6-[4-(2,6-dimethylphenoxy)piperidin-1-yl]pyridine-3-carboxamide
SMILESCc1cccc(C)c1OC1CCN(c2ccc(C(=O)NC3CC3)cn2)CC1
InChIInChI=1S/C22H27N3O2/c1-15-4-3-5-16(2)21(15)27-19-10-12-25(13-11-19)20-9-6-17(14-23-20)22(26)24-18-7-8-18/h3-6,9,14,18-19H,7-8,10-13H2,1-2H3,(H,24,26)
InChIKeyWIEPPRWMBLKYCE-UHFFFAOYSA-N
MW365.48 g/mol
LogP3.64
Rot. Bonds5

About N-cyclopropyl-6-[4-(2,6-dimethylphenoxy)piperidin-1-yl]pyridine-3-carboxamide

N-cyclopropyl-6-[4-(2,6-dimethylphenoxy)piperidin-1-yl]pyridine-3-carboxamide (PubChem CID 71891796) has the molecular formula C22H27N3O2 and a molecular weight of 365.48 g/mol. Its IUPAC name is N-cyclopropyl-6-[4-(2,6-dimethylphenoxy)piperidin-1-yl]pyridine-3-carboxamide.

Molecular Properties

Compound NameN-cyclopropyl-6-[4-(2,6-dimethylphenoxy)piperidin-1-yl]pyridine-3-carboxamide
PubChem CID71891796
Molecular FormulaC22H27N3O2
Molecular Weight365.48 g/mol
Exact Mass365.21
IUPAC NameN-cyclopropyl-6-[4-(2,6-dimethylphenoxy)piperidin-1-yl]pyridine-3-carboxamide
SMILESCc1cccc(C)c1OC1CCN(c2ccc(C(=O)NC3CC3)cn2)CC1
InChIInChI=1S/C22H27N3O2/c1-15-4-3-5-16(2)21(15)27-19-10-12-25(13-11-19)20-9-6-17(14-23-20)22(26)24-18-7-8-18/h3-6,9,14,18-19H,7-8,10-13H2,1-2H3,(H,24,26)
InChIKeyWIEPPRWMBLKYCE-UHFFFAOYSA-N
XLogP3.64
TPSA54.46 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500365.48
LogP ≤ 53.64
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-cyclopentyl-6-[4-(3-methylphenyl)piperazin-1-yl]pyridine-3-carboxamide
CID 109152244
N-cyclopropyl-6-[4-(2-hydroxyphenyl)piperazin-1-yl]pyridine-3-carboxamide
CID 47016815
N-piperidin-4-yl-6-pyrrolidin-1-ylpyridine-3-carboxamide
CID 119386740
6-(azetidin-1-yl)-N-[4-(pyridin-2-ylamino)cyclohexyl]pyridine-3-carboxamide
CID 136584132
N-cyclopropyl-6-[4-[(4-fluoro-3-methylphenoxy)methyl]piperidin-1-yl]pyridine-3-carboxamide
CID 44526655
cis-(1S,3R)-3-[[6-(azepan-1-yl)pyridine-3-carbonyl]amino]cyclopentane-1-carboxylic acid
CID 120675336
N-[4-(3-chloro-4-cyanophenoxy)cyclohexyl]-6-[4-(hydroxymethyl)piperidin-1-yl]pyridine-3-carboxamide
CID 134414273
N-[1-(2,6-dimethylpyrimidin-4-yl)piperidin-4-yl]-6-methylpyridine-3-carboxamide
CID 71977383
N-[1-[5-(hydroxycarbamoyl)-2-pyridinyl]piperidin-4-yl]-1H-indole-3-carboxamide
CID 11417616
[1-(5-carbamoyl-2-pyridinyl)piperidin-4-yl]carbamic acid
CID 69360370
4-(trifluoromethyl)-N-[1-[5-(trifluoromethyl)-2-pyridinyl]piperidin-4-yl]benzamide
CID 46475049
N-piperidin-3-yl-6-pyrrolidin-1-ylpyridine-3-carboxamide
CID 119425253

Frequently Asked Questions

What is the IUPAC name of N-cyclopropyl-6-[4-(2,6-dimethylphenoxy)piperidin-1-yl]pyridine-3-carboxamide?
The IUPAC name of N-cyclopropyl-6-[4-(2,6-dimethylphenoxy)piperidin-1-yl]pyridine-3-carboxamide (CID 71891796) is N-cyclopropyl-6-[4-(2,6-dimethylphenoxy)piperidin-1-yl]pyridine-3-carboxamide.
What is the SMILES notation for N-cyclopropyl-6-[4-(2,6-dimethylphenoxy)piperidin-1-yl]pyridine-3-carboxamide?
The canonical SMILES for N-cyclopropyl-6-[4-(2,6-dimethylphenoxy)piperidin-1-yl]pyridine-3-carboxamide is Cc1cccc(C)c1OC1CCN(c2ccc(C(=O)NC3CC3)cn2)CC1.
What is the InChIKey of N-cyclopropyl-6-[4-(2,6-dimethylphenoxy)piperidin-1-yl]pyridine-3-carboxamide?
The InChIKey is WIEPPRWMBLKYCE-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H27N3O2/c1-15-4-3-5-16(2)21(15)27-19-10-12-25(13-11-19)20-9-6-17(14-23-20)22(26)24-18-7-8-18/h3-6,9,14,18-19H,7-8,10-13H2,1-2H3,(H,24,26).
What are the key properties of N-cyclopropyl-6-[4-(2,6-dimethylphenoxy)piperidin-1-yl]pyridine-3-carboxamide?
N-cyclopropyl-6-[4-(2,6-dimethylphenoxy)piperidin-1-yl]pyridine-3-carboxamide has a molecular weight of 365.48 g/mol, XLogP of 3.64, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopropyl-6-[4-(2,6-dimethylphenoxy)piperidin-1-yl]pyridine-3-carboxamide is sourced from PubChem (CID 71891796), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).