2-[[2-[cyclohexen-1-yl(cyclopropyl)amino]-2-oxoethyl]-methylamino]-N-cyclopropylacetamide

C17H27N3O2 — CID 8910468

IUPAC2-[[2-[cyclohexen-1-yl(cyclopropyl)amino]-2-oxoethyl]-methylamino]-N-cyclopropylacetamide
SMILESCN(CC(=O)NC1CC1)CC(=O)N(C1=CCCCC1)C1CC1
InChIInChI=1S/C17H27N3O2/c1-19(11-16(21)18-13-7-8-13)12-17(22)20(15-9-10-15)14-5-3-2-4-6-14/h5,13,15H,2-4,6-12H2,1H3,(H,18,21)
InChIKeyMOSQWHUTEPZCBQ-UHFFFAOYSA-N
MW305.42 g/mol
LogP1.65
Rot. Bonds7

About 2-[[2-[cyclohexen-1-yl(cyclopropyl)amino]-2-oxoethyl]-methylamino]-N-cyclopropylacetamide

2-[[2-[cyclohexen-1-yl(cyclopropyl)amino]-2-oxoethyl]-methylamino]-N-cyclopropylacetamide (PubChem CID 8910468) has the molecular formula C17H27N3O2 and a molecular weight of 305.42 g/mol. Its IUPAC name is 2-[[2-[cyclohexen-1-yl(cyclopropyl)amino]-2-oxoethyl]-methylamino]-N-cyclopropylacetamide.

Molecular Properties

Compound Name2-[[2-[cyclohexen-1-yl(cyclopropyl)amino]-2-oxoethyl]-methylamino]-N-cyclopropylacetamide
PubChem CID8910468
Molecular FormulaC17H27N3O2
Molecular Weight305.42 g/mol
Exact Mass305.21
IUPAC Name2-[[2-[cyclohexen-1-yl(cyclopropyl)amino]-2-oxoethyl]-methylamino]-N-cyclopropylacetamide
SMILESCN(CC(=O)NC1CC1)CC(=O)N(C1=CCCCC1)C1CC1
InChIInChI=1S/C17H27N3O2/c1-19(11-16(21)18-13-7-8-13)12-17(22)20(15-9-10-15)14-5-3-2-4-6-14/h5,13,15H,2-4,6-12H2,1H3,(H,18,21)
InChIKeyMOSQWHUTEPZCBQ-UHFFFAOYSA-N
XLogP1.65
TPSA52.65 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500305.42
LogP ≤ 51.65
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-[[2-[Cyclohexen-1-yl(cyclopropyl)amino]-2-oxoethyl]-methylamino]acetamide
CID 53509847
2-[[2-[Cyclopenten-1-yl(ethyl)amino]-2-oxoethyl]-propan-2-ylamino]acetamide
CID 56809318
2-[[2-[Cyclohexen-1-yl(cyclopropyl)amino]-2-oxoethyl]-propan-2-ylamino]acetamide
CID 56809319
N-tert-butyl-2-[4-[2-[cyclohexen-1-yl(cyclopropyl)amino]-2-oxoethyl]piperazin-1-yl]acetamide
CID 17431600
N-[4-[4-(cyclopropylmethyl)piperazin-1-yl]cyclohex-3-en-1-yl]acetamide
CID 68272063
N-cyclopropyl-N-hexyl-6-methyl-4-oxo-1H-pyridine-2-carboxamide
CID 142682970
N-(cyclohexen-1-yl)-2-(3-oxopiperazin-1-ium-1-yl)-N-propylacetamide
CID 8547842
N-(cyclohexen-1-yl)-2-(3-oxopiperazin-1-yl)-N-propylacetamide
CID 8547843
N-(cyclohexen-1-yl)-N-cyclopropyl-2-(3-oxopiperazin-1-ium-1-yl)acetamide
CID 8709831
N-(cyclohexen-1-yl)-N-cyclopropyl-2-(3-oxopiperazin-1-yl)acetamide
CID 8709832
N-(cyclohexen-1-yl)-N-ethyl-2-(3-oxopiperazin-1-ium-1-yl)acetamide
CID 8709857
N-(cyclohexen-1-yl)-N-ethyl-2-(3-oxopiperazin-1-yl)acetamide
CID 8709858

Frequently Asked Questions

What is the IUPAC name of 2-[[2-[cyclohexen-1-yl(cyclopropyl)amino]-2-oxoethyl]-methylamino]-N-cyclopropylacetamide?
The IUPAC name of 2-[[2-[cyclohexen-1-yl(cyclopropyl)amino]-2-oxoethyl]-methylamino]-N-cyclopropylacetamide (CID 8910468) is 2-[[2-[cyclohexen-1-yl(cyclopropyl)amino]-2-oxoethyl]-methylamino]-N-cyclopropylacetamide.
What is the SMILES notation for 2-[[2-[cyclohexen-1-yl(cyclopropyl)amino]-2-oxoethyl]-methylamino]-N-cyclopropylacetamide?
The canonical SMILES for 2-[[2-[cyclohexen-1-yl(cyclopropyl)amino]-2-oxoethyl]-methylamino]-N-cyclopropylacetamide is CN(CC(=O)NC1CC1)CC(=O)N(C1=CCCCC1)C1CC1.
What is the InChIKey of 2-[[2-[cyclohexen-1-yl(cyclopropyl)amino]-2-oxoethyl]-methylamino]-N-cyclopropylacetamide?
The InChIKey is MOSQWHUTEPZCBQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H27N3O2/c1-19(11-16(21)18-13-7-8-13)12-17(22)20(15-9-10-15)14-5-3-2-4-6-14/h5,13,15H,2-4,6-12H2,1H3,(H,18,21).
What are the key properties of 2-[[2-[cyclohexen-1-yl(cyclopropyl)amino]-2-oxoethyl]-methylamino]-N-cyclopropylacetamide?
2-[[2-[cyclohexen-1-yl(cyclopropyl)amino]-2-oxoethyl]-methylamino]-N-cyclopropylacetamide has a molecular weight of 305.42 g/mol, XLogP of 1.65, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[[2-[cyclohexen-1-yl(cyclopropyl)amino]-2-oxoethyl]-methylamino]-N-cyclopropylacetamide is sourced from PubChem (CID 8910468), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).