1-(ethylamino)-3-[methyl(oxolan-3-yl)amino]cyclohexane-1-carboxamide

C14H27N3O2 — CID 82743164

IUPAC1-(ethylamino)-3-[methyl(oxolan-3-yl)amino]cyclohexane-1-carboxamide
SMILESCCNC1(C(N)=O)CCCC(N(C)C2CCOC2)C1
InChIInChI=1S/C14H27N3O2/c1-3-16-14(13(15)18)7-4-5-11(9-14)17(2)12-6-8-19-10-12/h11-12,16H,3-10H2,1-2H3,(H2,15,18)
InChIKeyQEWMAHBQOBCXIB-UHFFFAOYSA-N
MW269.39 g/mol
LogP0.48
Rot. Bonds5

About 1-(ethylamino)-3-[methyl(oxolan-3-yl)amino]cyclohexane-1-carboxamide

1-(ethylamino)-3-[methyl(oxolan-3-yl)amino]cyclohexane-1-carboxamide (PubChem CID 82743164) has the molecular formula C14H27N3O2 and a molecular weight of 269.39 g/mol. Its IUPAC name is 1-(ethylamino)-3-[methyl(oxolan-3-yl)amino]cyclohexane-1-carboxamide.

Molecular Properties

Compound Name1-(ethylamino)-3-[methyl(oxolan-3-yl)amino]cyclohexane-1-carboxamide
PubChem CID82743164
Molecular FormulaC14H27N3O2
Molecular Weight269.39 g/mol
Exact Mass269.21
IUPAC Name1-(ethylamino)-3-[methyl(oxolan-3-yl)amino]cyclohexane-1-carboxamide
SMILESCCNC1(C(N)=O)CCCC(N(C)C2CCOC2)C1
InChIInChI=1S/C14H27N3O2/c1-3-16-14(13(15)18)7-4-5-11(9-14)17(2)12-6-8-19-10-12/h11-12,16H,3-10H2,1-2H3,(H2,15,18)
InChIKeyQEWMAHBQOBCXIB-UHFFFAOYSA-N
XLogP0.48
TPSA67.59 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500269.39
LogP ≤ 50.48
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

methyl 1-(ethylamino)-3-[methyl(oxolan-3-yl)amino]cyclohexane-1-carboxylate
CID 82743238
3-[methyl(oxolan-3-yl)amino]-1-(propylamino)cyclohexane-1-carboxylic acid
CID 82743171
ethyl 1-(ethylamino)-3-[methyl(oxolan-3-yl)amino]cyclopentane-1-carboxylate
CID 82743477
methyl 1-(ethylamino)-3-[methyl(oxolan-3-yl)amino]cyclopentane-1-carboxylate
CID 82743319
3-[cyclopropylmethyl(methyl)amino]-1-(ethylamino)cyclohexane-1-carboxamide
CID 79641470
1-(ethylamino)-3-[methyl(pentan-3-yl)amino]cyclohexane-1-carboxamide
CID 79636536
1-(ethylamino)-3-[methyl(2,2,2-trifluoroethyl)amino]cyclohexane-1-carboxamide
CID 79641468
3-[bis(2-methoxyethyl)amino]-1-(ethylamino)cyclohexane-1-carboxamide
CID 79627693
3-[methyl(oxan-4-yl)amino]-1-(propan-2-ylamino)cyclopentane-1-carboxamide
CID 79655558
1-(ethylamino)-3-[methyl-[(1-methylpyrrolidin-2-yl)methyl]amino]cyclohexane-1-carboxamide
CID 79633998
[1-(ethylamino)-3-[methyl(oxan-4-yl)amino]cyclohexyl]methanol
CID 79641104
3-[cyclohexyl(methyl)amino]-1-(propan-2-ylamino)cyclohexane-1-carboxamide
CID 79626764

Frequently Asked Questions

What is the IUPAC name of 1-(ethylamino)-3-[methyl(oxolan-3-yl)amino]cyclohexane-1-carboxamide?
The IUPAC name of 1-(ethylamino)-3-[methyl(oxolan-3-yl)amino]cyclohexane-1-carboxamide (CID 82743164) is 1-(ethylamino)-3-[methyl(oxolan-3-yl)amino]cyclohexane-1-carboxamide.
What is the SMILES notation for 1-(ethylamino)-3-[methyl(oxolan-3-yl)amino]cyclohexane-1-carboxamide?
The canonical SMILES for 1-(ethylamino)-3-[methyl(oxolan-3-yl)amino]cyclohexane-1-carboxamide is CCNC1(C(N)=O)CCCC(N(C)C2CCOC2)C1.
What is the InChIKey of 1-(ethylamino)-3-[methyl(oxolan-3-yl)amino]cyclohexane-1-carboxamide?
The InChIKey is QEWMAHBQOBCXIB-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H27N3O2/c1-3-16-14(13(15)18)7-4-5-11(9-14)17(2)12-6-8-19-10-12/h11-12,16H,3-10H2,1-2H3,(H2,15,18).
What are the key properties of 1-(ethylamino)-3-[methyl(oxolan-3-yl)amino]cyclohexane-1-carboxamide?
1-(ethylamino)-3-[methyl(oxolan-3-yl)amino]cyclohexane-1-carboxamide has a molecular weight of 269.39 g/mol, XLogP of 0.48, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(ethylamino)-3-[methyl(oxolan-3-yl)amino]cyclohexane-1-carboxamide is sourced from PubChem (CID 82743164), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).