N-cyclohexyl-4-[[(2R)-1-imidazol-1-ylpropan-2-yl]amino]piperidine-1-carboxamide

C18H31N5O — CID 95388436

IUPACN-cyclohexyl-4-[[(2R)-1-imidazol-1-ylpropan-2-yl]amino]piperidine-1-carboxamide
SMILESC[C@H](Cn1ccnc1)NC1CCN(C(=O)NC2CCCCC2)CC1
InChIInChI=1S/C18H31N5O/c1-15(13-22-12-9-19-14-22)20-17-7-10-23(11-8-17)18(24)21-16-5-3-2-4-6-16/h9,12,14-17,20H,2-8,10-11,13H2,1H3,(H,21,24)/t15-/m1/s1
InChIKeyDMWWYEDUHDRWML-OAHLLOKOSA-N
MW333.48 g/mol
LogP2.37
Rot. Bonds5

About N-cyclohexyl-4-[[(2R)-1-imidazol-1-ylpropan-2-yl]amino]piperidine-1-carboxamide

N-cyclohexyl-4-[[(2R)-1-imidazol-1-ylpropan-2-yl]amino]piperidine-1-carboxamide (PubChem CID 95388436) has the molecular formula C18H31N5O and a molecular weight of 333.48 g/mol. Its IUPAC name is N-cyclohexyl-4-[[(2R)-1-imidazol-1-ylpropan-2-yl]amino]piperidine-1-carboxamide.

Molecular Properties

Compound NameN-cyclohexyl-4-[[(2R)-1-imidazol-1-ylpropan-2-yl]amino]piperidine-1-carboxamide
PubChem CID95388436
Molecular FormulaC18H31N5O
Molecular Weight333.48 g/mol
Exact Mass333.25
IUPAC NameN-cyclohexyl-4-[[(2R)-1-imidazol-1-ylpropan-2-yl]amino]piperidine-1-carboxamide
SMILESC[C@H](Cn1ccnc1)NC1CCN(C(=O)NC2CCCCC2)CC1
InChIInChI=1S/C18H31N5O/c1-15(13-22-12-9-19-14-22)20-17-7-10-23(11-8-17)18(24)21-16-5-3-2-4-6-16/h9,12,14-17,20H,2-8,10-11,13H2,1H3,(H,21,24)/t15-/m1/s1
InChIKeyDMWWYEDUHDRWML-OAHLLOKOSA-N
XLogP2.37
TPSA62.19 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500333.48
LogP ≤ 52.37
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze N-cyclohexyl-4-[[(2R)-1-imidazol-1-ylpropan-2-yl]amino]piperidine-1-carboxamide with MolForge

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Related Compounds

N-cyclohexyl-4-(1-hydroxypropan-2-ylamino)piperidine-1-carboxamide
CID 50977190
N-(1-imidazol-1-ylpropan-2-yl)thian-4-amine
CID 43435651
1-[(2R)-1-imidazol-1-ylpropan-2-yl]-3-(1-methylsulfonylpiperidin-4-yl)urea
CID 94049873
(3R)-N-[(2S)-1-imidazol-1-ylpropan-2-yl]-3-(methanesulfonamido)piperidine-1-carboxamide
CID 95134502
4-(cyclohexylcarbamoylamino)-N-[4-(imidazol-1-ylmethyl)phenyl]piperidine-1-carboxamide
CID 86933267
N-(1-imidazol-1-ylpropan-2-yl)-3-methylcyclobutan-1-amine
CID 104859674
N-(1-imidazol-1-ylpropan-2-yl)-4-propylcycloheptan-1-amine
CID 65091735
N-cyclohexyl-4-(propanoylamino)piperidine-1-carboxamide
CID 110820925
N-[(2S)-1-imidazol-1-ylpropan-2-yl]thiomorpholine-4-carboxamide
CID 94122810
2-[4-[[(2R)-1-imidazol-1-ylpropan-2-yl]carbamoylamino]piperidin-1-yl]-N-methylacetamide
CID 95134639
N-(1-imidazol-1-ylpropan-2-yl)thiolan-3-amine
CID 43749649
2-(1-imidazol-1-ylpropan-2-ylamino)-1-pyrrolidin-1-ylpropan-1-one
CID 54958720

Frequently Asked Questions

What is the IUPAC name of N-cyclohexyl-4-[[(2R)-1-imidazol-1-ylpropan-2-yl]amino]piperidine-1-carboxamide?
The IUPAC name of N-cyclohexyl-4-[[(2R)-1-imidazol-1-ylpropan-2-yl]amino]piperidine-1-carboxamide (CID 95388436) is N-cyclohexyl-4-[[(2R)-1-imidazol-1-ylpropan-2-yl]amino]piperidine-1-carboxamide.
What is the SMILES notation for N-cyclohexyl-4-[[(2R)-1-imidazol-1-ylpropan-2-yl]amino]piperidine-1-carboxamide?
The canonical SMILES for N-cyclohexyl-4-[[(2R)-1-imidazol-1-ylpropan-2-yl]amino]piperidine-1-carboxamide is C[C@H](Cn1ccnc1)NC1CCN(C(=O)NC2CCCCC2)CC1.
What is the InChIKey of N-cyclohexyl-4-[[(2R)-1-imidazol-1-ylpropan-2-yl]amino]piperidine-1-carboxamide?
The InChIKey is DMWWYEDUHDRWML-OAHLLOKOSA-N. The full InChI is InChI=1S/C18H31N5O/c1-15(13-22-12-9-19-14-22)20-17-7-10-23(11-8-17)18(24)21-16-5-3-2-4-6-16/h9,12,14-17,20H,2-8,10-11,13H2,1H3,(H,21,24)/t15-/m1/s1.
What are the key properties of N-cyclohexyl-4-[[(2R)-1-imidazol-1-ylpropan-2-yl]amino]piperidine-1-carboxamide?
N-cyclohexyl-4-[[(2R)-1-imidazol-1-ylpropan-2-yl]amino]piperidine-1-carboxamide has a molecular weight of 333.48 g/mol, XLogP of 2.37, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclohexyl-4-[[(2R)-1-imidazol-1-ylpropan-2-yl]amino]piperidine-1-carboxamide is sourced from PubChem (CID 95388436), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).