N-[1-(furan-2-yl)ethyl]-2-[methyl-[4-(methylamino)cyclohexyl]amino]acetamide

C16H27N3O2 — CID 79118481

IUPACN-[1-(furan-2-yl)ethyl]-2-[methyl-[4-(methylamino)cyclohexyl]amino]acetamide
SMILESCNC1CCC(N(C)CC(=O)NC(C)c2ccco2)CC1
InChIInChI=1S/C16H27N3O2/c1-12(15-5-4-10-21-15)18-16(20)11-19(3)14-8-6-13(17-2)7-9-14/h4-5,10,12-14,17H,6-9,11H2,1-3H3,(H,18,20)
InChIKeyRHTDNEGWVBNVFA-UHFFFAOYSA-N
MW293.41 g/mol
LogP1.92
Rot. Bonds6

About N-[1-(furan-2-yl)ethyl]-2-[methyl-[4-(methylamino)cyclohexyl]amino]acetamide

N-[1-(furan-2-yl)ethyl]-2-[methyl-[4-(methylamino)cyclohexyl]amino]acetamide (PubChem CID 79118481) has the molecular formula C16H27N3O2 and a molecular weight of 293.41 g/mol. Its IUPAC name is N-[1-(furan-2-yl)ethyl]-2-[methyl-[4-(methylamino)cyclohexyl]amino]acetamide.

Molecular Properties

Compound NameN-[1-(furan-2-yl)ethyl]-2-[methyl-[4-(methylamino)cyclohexyl]amino]acetamide
PubChem CID79118481
Molecular FormulaC16H27N3O2
Molecular Weight293.41 g/mol
Exact Mass293.21
IUPAC NameN-[1-(furan-2-yl)ethyl]-2-[methyl-[4-(methylamino)cyclohexyl]amino]acetamide
SMILESCNC1CCC(N(C)CC(=O)NC(C)c2ccco2)CC1
InChIInChI=1S/C16H27N3O2/c1-12(15-5-4-10-21-15)18-16(20)11-19(3)14-8-6-13(17-2)7-9-14/h4-5,10,12-14,17H,6-9,11H2,1-3H3,(H,18,20)
InChIKeyRHTDNEGWVBNVFA-UHFFFAOYSA-N
XLogP1.92
TPSA57.51 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500293.41
LogP ≤ 51.92
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

2-[8-azabicyclo[3.2.1]octan-3-yl(methyl)amino]-N-[1-(furan-2-yl)ethyl]acetamide
CID 61231079
2-[cyclohexyl-[(2S)-2-hydroxypropyl]amino]-N-[(1R)-1-(furan-2-yl)ethyl]acetamide
CID 98761112
2-[cyclopropyl(3-hydroxypropyl)amino]-N-[(1S)-1-(furan-2-yl)ethyl]acetamide
CID 95346543
2-(cyclopentylamino)-N-[1-(furan-2-yl)ethyl]acetamide
CID 60686918
3-(cyclopropylamino)-N-[(1R)-1-(furan-2-yl)ethyl]propanamide
CID 81400565
2-[[2-[1-(furan-2-yl)ethylamino]-2-oxoethyl]-methylamino]acetic acid
CID 43442423
N-[1-(furan-2-yl)ethyl]-2-[methyl(pyrrolidin-2-ylmethyl)amino]acetamide
CID 106614141
2-[cyclopropyl-[2-(4-fluorophenyl)-2-hydroxyethyl]amino]-N-[1-(furan-2-yl)ethyl]acetamide
CID 111432073
2-[azetidin-3-yl(propyl)amino]-N-[1-(furan-2-yl)ethyl]acetamide
CID 66216723
2-[[2-[1-(furan-2-yl)ethylamino]-2-oxoethyl]-prop-2-ynylamino]acetic acid
CID 79275070
ethyl 2-[[2-[1-(furan-2-yl)ethylamino]-2-oxoethyl]-methylamino]acetate
CID 62013143
2-[cyclohexyl(methyl)amino]-N-[(1R)-1-phenylethyl]acetamide
CID 8004439

Frequently Asked Questions

What is the IUPAC name of N-[1-(furan-2-yl)ethyl]-2-[methyl-[4-(methylamino)cyclohexyl]amino]acetamide?
The IUPAC name of N-[1-(furan-2-yl)ethyl]-2-[methyl-[4-(methylamino)cyclohexyl]amino]acetamide (CID 79118481) is N-[1-(furan-2-yl)ethyl]-2-[methyl-[4-(methylamino)cyclohexyl]amino]acetamide.
What is the SMILES notation for N-[1-(furan-2-yl)ethyl]-2-[methyl-[4-(methylamino)cyclohexyl]amino]acetamide?
The canonical SMILES for N-[1-(furan-2-yl)ethyl]-2-[methyl-[4-(methylamino)cyclohexyl]amino]acetamide is CNC1CCC(N(C)CC(=O)NC(C)c2ccco2)CC1.
What is the InChIKey of N-[1-(furan-2-yl)ethyl]-2-[methyl-[4-(methylamino)cyclohexyl]amino]acetamide?
The InChIKey is RHTDNEGWVBNVFA-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H27N3O2/c1-12(15-5-4-10-21-15)18-16(20)11-19(3)14-8-6-13(17-2)7-9-14/h4-5,10,12-14,17H,6-9,11H2,1-3H3,(H,18,20).
What are the key properties of N-[1-(furan-2-yl)ethyl]-2-[methyl-[4-(methylamino)cyclohexyl]amino]acetamide?
N-[1-(furan-2-yl)ethyl]-2-[methyl-[4-(methylamino)cyclohexyl]amino]acetamide has a molecular weight of 293.41 g/mol, XLogP of 1.92, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-(furan-2-yl)ethyl]-2-[methyl-[4-(methylamino)cyclohexyl]amino]acetamide is sourced from PubChem (CID 79118481), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).