N-cyclohexyl-4-[[(1R)-1-(oxan-4-yl)ethyl]amino]piperidine-1-carboxamide

C19H35N3O2 — CID 97070572

IUPACN-cyclohexyl-4-[[(1R)-1-(oxan-4-yl)ethyl]amino]piperidine-1-carboxamide
SMILESC[C@@H](NC1CCN(C(=O)NC2CCCCC2)CC1)C1CCOCC1
InChIInChI=1S/C19H35N3O2/c1-15(16-9-13-24-14-10-16)20-18-7-11-22(12-8-18)19(23)21-17-5-3-2-4-6-17/h15-18,20H,2-14H2,1H3,(H,21,23)/t15-/m1/s1
InChIKeyYNEHXNJVMUXWQX-OAHLLOKOSA-N
MW337.51 g/mol
LogP2.90
Rot. Bonds4

About N-cyclohexyl-4-[[(1R)-1-(oxan-4-yl)ethyl]amino]piperidine-1-carboxamide

N-cyclohexyl-4-[[(1R)-1-(oxan-4-yl)ethyl]amino]piperidine-1-carboxamide (PubChem CID 97070572) has the molecular formula C19H35N3O2 and a molecular weight of 337.51 g/mol. Its IUPAC name is N-cyclohexyl-4-[[(1R)-1-(oxan-4-yl)ethyl]amino]piperidine-1-carboxamide.

Molecular Properties

Compound NameN-cyclohexyl-4-[[(1R)-1-(oxan-4-yl)ethyl]amino]piperidine-1-carboxamide
PubChem CID97070572
Molecular FormulaC19H35N3O2
Molecular Weight337.51 g/mol
Exact Mass337.27
IUPAC NameN-cyclohexyl-4-[[(1R)-1-(oxan-4-yl)ethyl]amino]piperidine-1-carboxamide
SMILESC[C@@H](NC1CCN(C(=O)NC2CCCCC2)CC1)C1CCOCC1
InChIInChI=1S/C19H35N3O2/c1-15(16-9-13-24-14-10-16)20-18-7-11-22(12-8-18)19(23)21-17-5-3-2-4-6-17/h15-18,20H,2-14H2,1H3,(H,21,23)/t15-/m1/s1
InChIKeyYNEHXNJVMUXWQX-OAHLLOKOSA-N
XLogP2.90
TPSA53.60 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500337.51
LogP ≤ 52.90
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze N-cyclohexyl-4-[[(1R)-1-(oxan-4-yl)ethyl]amino]piperidine-1-carboxamide with MolForge

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Related Compounds

N-(1-cyclohexylethyl)oxepan-4-amine
CID 65079313
N-cyclohexyl-4-propan-2-ylazepane-1-carboxamide
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N-cyclohexyl-4-(1-hydroxypropan-2-ylamino)piperidine-1-carboxamide
CID 50977190
tert-butyl (4R)-4-[[(1R)-1-(oxan-4-yl)ethyl]amino]azepane-1-carboxylate
CID 99821438
tert-butyl (4S)-4-[[(1S)-1-(oxan-4-yl)ethyl]amino]azepane-1-carboxylate
CID 99821439
N-cyclohexyl-4-(propanoylamino)piperidine-1-carboxamide
CID 110820925
N-cyclohexyl-2-[1-(oxan-4-yl)ethylamino]acetamide
CID 103902052
4-[[(1S)-1-cyclopentylethyl]amino]piperidine-1-carboxamide
CID 81386220
4-acetamido-N-cyclopentylpiperidine-1-carboxamide
CID 49468459
N-[1-(oxan-4-yl)ethyl]morpholine-4-carboxamide
CID 103768181
N-cycloheptylpiperidine-1-carboxamide
CID 54054704
N-[(1S)-1-cycloheptylethyl]cycloheptanamine
CID 81389840

Frequently Asked Questions

What is the IUPAC name of N-cyclohexyl-4-[[(1R)-1-(oxan-4-yl)ethyl]amino]piperidine-1-carboxamide?
The IUPAC name of N-cyclohexyl-4-[[(1R)-1-(oxan-4-yl)ethyl]amino]piperidine-1-carboxamide (CID 97070572) is N-cyclohexyl-4-[[(1R)-1-(oxan-4-yl)ethyl]amino]piperidine-1-carboxamide.
What is the SMILES notation for N-cyclohexyl-4-[[(1R)-1-(oxan-4-yl)ethyl]amino]piperidine-1-carboxamide?
The canonical SMILES for N-cyclohexyl-4-[[(1R)-1-(oxan-4-yl)ethyl]amino]piperidine-1-carboxamide is C[C@@H](NC1CCN(C(=O)NC2CCCCC2)CC1)C1CCOCC1.
What is the InChIKey of N-cyclohexyl-4-[[(1R)-1-(oxan-4-yl)ethyl]amino]piperidine-1-carboxamide?
The InChIKey is YNEHXNJVMUXWQX-OAHLLOKOSA-N. The full InChI is InChI=1S/C19H35N3O2/c1-15(16-9-13-24-14-10-16)20-18-7-11-22(12-8-18)19(23)21-17-5-3-2-4-6-17/h15-18,20H,2-14H2,1H3,(H,21,23)/t15-/m1/s1.
What are the key properties of N-cyclohexyl-4-[[(1R)-1-(oxan-4-yl)ethyl]amino]piperidine-1-carboxamide?
N-cyclohexyl-4-[[(1R)-1-(oxan-4-yl)ethyl]amino]piperidine-1-carboxamide has a molecular weight of 337.51 g/mol, XLogP of 2.90, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclohexyl-4-[[(1R)-1-(oxan-4-yl)ethyl]amino]piperidine-1-carboxamide is sourced from PubChem (CID 97070572), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).