N-cycloheptyl-2-[(1-hydroxycyclopentyl)methyl-methylamino]acetamide

C16H30N2O2 — CID 115758301

IUPACN-cycloheptyl-2-[(1-hydroxycyclopentyl)methyl-methylamino]acetamide
SMILESCN(CC(=O)NC1CCCCCC1)CC1(O)CCCC1
InChIInChI=1S/C16H30N2O2/c1-18(13-16(20)10-6-7-11-16)12-15(19)17-14-8-4-2-3-5-9-14/h14,20H,2-13H2,1H3,(H,17,19)
InChIKeyQXMMJUOFYHGLBN-UHFFFAOYSA-N
MW282.43 g/mol
LogP2.06
Rot. Bonds5

About N-cycloheptyl-2-[(1-hydroxycyclopentyl)methyl-methylamino]acetamide

N-cycloheptyl-2-[(1-hydroxycyclopentyl)methyl-methylamino]acetamide (PubChem CID 115758301) has the molecular formula C16H30N2O2 and a molecular weight of 282.43 g/mol. Its IUPAC name is N-cycloheptyl-2-[(1-hydroxycyclopentyl)methyl-methylamino]acetamide.

Molecular Properties

Compound NameN-cycloheptyl-2-[(1-hydroxycyclopentyl)methyl-methylamino]acetamide
PubChem CID115758301
Molecular FormulaC16H30N2O2
Molecular Weight282.43 g/mol
Exact Mass282.23
IUPAC NameN-cycloheptyl-2-[(1-hydroxycyclopentyl)methyl-methylamino]acetamide
SMILESCN(CC(=O)NC1CCCCCC1)CC1(O)CCCC1
InChIInChI=1S/C16H30N2O2/c1-18(13-16(20)10-6-7-11-16)12-15(19)17-14-8-4-2-3-5-9-14/h14,20H,2-13H2,1H3,(H,17,19)
InChIKeyQXMMJUOFYHGLBN-UHFFFAOYSA-N
XLogP2.06
TPSA52.57 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500282.43
LogP ≤ 52.06
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

4-[[[2-(cyclopropylamino)-2-oxoethyl]-methylamino]methyl]-4-hydroxycyclohexane-1-carboxylic acid
CID 106498637
N-cyclopropyl-2-[(3-hydroxypyrrolidin-3-yl)methyl-methylamino]acetamide
CID 114761074
methyl 2-[[2-(cyclohexylamino)-2-oxoethyl]-methylamino]acetate
CID 55028611
3-[[2-(cyclohexylamino)-2-oxoethyl]-methylamino]propanoic acid
CID 60986544
N-cyclohexyl-2-[(1-hydroxycyclopentyl)methyl-methylamino]-N-methylacetamide
CID 115749267
N-cyclopentyl-2-[[2-(dimethylamino)-2-oxoethyl]-methylamino]acetamide
CID 78809352
2-[(2-amino-2-sulfanylideneethyl)-methylamino]-N-cyclohexylacetamide
CID 60729940
2-[(2-amino-2-sulfanylideneethyl)-methylamino]-N-cycloheptylacetamide
CID 55024099
N-[1-[2-[(1-hydroxycycloheptyl)methyl-methylamino]acetyl]piperidin-3-yl]acetamide
CID 154741836
4-[[2-(cycloheptylamino)-2-oxoethyl]-methylamino]butanoic acid
CID 55006417
2-[(2-amino-2-sulfanylideneethyl)-methylamino]-N-cyclopentylacetamide
CID 60730257
2-[(1-hydroxycyclopentyl)methyl-methylamino]-N-prop-2-enylacetamide
CID 115758597

Frequently Asked Questions

What is the IUPAC name of N-cycloheptyl-2-[(1-hydroxycyclopentyl)methyl-methylamino]acetamide?
The IUPAC name of N-cycloheptyl-2-[(1-hydroxycyclopentyl)methyl-methylamino]acetamide (CID 115758301) is N-cycloheptyl-2-[(1-hydroxycyclopentyl)methyl-methylamino]acetamide.
What is the SMILES notation for N-cycloheptyl-2-[(1-hydroxycyclopentyl)methyl-methylamino]acetamide?
The canonical SMILES for N-cycloheptyl-2-[(1-hydroxycyclopentyl)methyl-methylamino]acetamide is CN(CC(=O)NC1CCCCCC1)CC1(O)CCCC1.
What is the InChIKey of N-cycloheptyl-2-[(1-hydroxycyclopentyl)methyl-methylamino]acetamide?
The InChIKey is QXMMJUOFYHGLBN-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H30N2O2/c1-18(13-16(20)10-6-7-11-16)12-15(19)17-14-8-4-2-3-5-9-14/h14,20H,2-13H2,1H3,(H,17,19).
What are the key properties of N-cycloheptyl-2-[(1-hydroxycyclopentyl)methyl-methylamino]acetamide?
N-cycloheptyl-2-[(1-hydroxycyclopentyl)methyl-methylamino]acetamide has a molecular weight of 282.43 g/mol, XLogP of 2.06, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-cycloheptyl-2-[(1-hydroxycyclopentyl)methyl-methylamino]acetamide is sourced from PubChem (CID 115758301), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).