N-piperidin-4-yl-3-propan-2-yl-1,2-dihydroimidazole-5-carboxamide

C12H22N4O — CID 177230183

IUPACN-piperidin-4-yl-3-propan-2-yl-1,2-dihydroimidazole-5-carboxamide
SMILESCC(C)N1C=C(C(=O)NC2CCNCC2)NC1
InChIInChI=1S/C12H22N4O/c1-9(2)16-7-11(14-8-16)12(17)15-10-3-5-13-6-4-10/h7,9-10,13-14H,3-6,8H2,1-2H3,(H,15,17)
InChIKeyXXDIUNSDOPPFST-UHFFFAOYSA-N
MW238.33 g/mol
LogP-0.03
Rot. Bonds3

About N-piperidin-4-yl-3-propan-2-yl-1,2-dihydroimidazole-5-carboxamide

N-piperidin-4-yl-3-propan-2-yl-1,2-dihydroimidazole-5-carboxamide (PubChem CID 177230183) has the molecular formula C12H22N4O and a molecular weight of 238.33 g/mol. Its IUPAC name is N-piperidin-4-yl-3-propan-2-yl-1,2-dihydroimidazole-5-carboxamide.

Molecular Properties

Compound NameN-piperidin-4-yl-3-propan-2-yl-1,2-dihydroimidazole-5-carboxamide
PubChem CID177230183
Molecular FormulaC12H22N4O
Molecular Weight238.33 g/mol
Exact Mass238.18
IUPAC NameN-piperidin-4-yl-3-propan-2-yl-1,2-dihydroimidazole-5-carboxamide
SMILESCC(C)N1C=C(C(=O)NC2CCNCC2)NC1
InChIInChI=1S/C12H22N4O/c1-9(2)16-7-11(14-8-16)12(17)15-10-3-5-13-6-4-10/h7,9-10,13-14H,3-6,8H2,1-2H3,(H,15,17)
InChIKeyXXDIUNSDOPPFST-UHFFFAOYSA-N
XLogP-0.03
TPSA56.40 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500238.33
LogP ≤ 5-0.03
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Related Compounds

N-piperidin-4-yl-2,3-dihydro-1H-imidazole-4-carboxamide
CID 163910569
1,1,3-trioxo-N-piperidin-4-yl-2-propan-2-yl-1,2-benzothiazole-6-carboxamide;hydrochloride
CID 119389740
N-piperidin-4-yl-4-(propan-2-ylamino)pyridine-3-carboxamide
CID 172633218
N-piperidin-4-yl-4-(1,1,1-trifluoropropan-2-yl)benzamide
CID 162554246
2-methoxy-N-piperidin-4-ylbenzamide
CID 16780894
2-fluoro-3-methyl-N-piperidin-4-ylbenzamide
CID 81459818
N-piperidin-4-yl-1H-pyrazole-5-carboxamide
CID 62050322
N-(azepan-4-yl)-4-nitro-1-propan-2-ylpyrrole-2-carboxamide
CID 107172299
N-piperidin-4-ylimidazo[1,2-a]pyridine-8-carboxamide
CID 110475049
N-(azepan-4-yl)-2-methylpyrazole-3-carboxamide
CID 105059420
3-bromo-4-methyl-N-pyrrolidin-3-ylbenzamide
CID 81472649
5-ethyl-N-piperidin-4-ylfuran-2-carboxamide
CID 78981214

Frequently Asked Questions

What is the IUPAC name of N-piperidin-4-yl-3-propan-2-yl-1,2-dihydroimidazole-5-carboxamide?
The IUPAC name of N-piperidin-4-yl-3-propan-2-yl-1,2-dihydroimidazole-5-carboxamide (CID 177230183) is N-piperidin-4-yl-3-propan-2-yl-1,2-dihydroimidazole-5-carboxamide.
What is the SMILES notation for N-piperidin-4-yl-3-propan-2-yl-1,2-dihydroimidazole-5-carboxamide?
The canonical SMILES for N-piperidin-4-yl-3-propan-2-yl-1,2-dihydroimidazole-5-carboxamide is CC(C)N1C=C(C(=O)NC2CCNCC2)NC1.
What is the InChIKey of N-piperidin-4-yl-3-propan-2-yl-1,2-dihydroimidazole-5-carboxamide?
The InChIKey is XXDIUNSDOPPFST-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H22N4O/c1-9(2)16-7-11(14-8-16)12(17)15-10-3-5-13-6-4-10/h7,9-10,13-14H,3-6,8H2,1-2H3,(H,15,17).
What are the key properties of N-piperidin-4-yl-3-propan-2-yl-1,2-dihydroimidazole-5-carboxamide?
N-piperidin-4-yl-3-propan-2-yl-1,2-dihydroimidazole-5-carboxamide has a molecular weight of 238.33 g/mol, XLogP of -0.03, 3 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-piperidin-4-yl-3-propan-2-yl-1,2-dihydroimidazole-5-carboxamide is sourced from PubChem (CID 177230183), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).