2-[(2-hydroxycyclohexyl)methylamino]-N-propan-2-ylacetamide

C12H24N2O2 — CID 64911813

IUPAC2-[(2-hydroxycyclohexyl)methylamino]-N-propan-2-ylacetamide
SMILESCC(C)NC(=O)CNCC1CCCCC1O
InChIInChI=1S/C12H24N2O2/c1-9(2)14-12(16)8-13-7-10-5-3-4-6-11(10)15/h9-11,13,15H,3-8H2,1-2H3,(H,14,16)
InChIKeyREUJXPJLFNEUPP-UHFFFAOYSA-N
MW228.34 g/mol
LogP0.65
Rot. Bonds5

About 2-[(2-hydroxycyclohexyl)methylamino]-N-propan-2-ylacetamide

2-[(2-hydroxycyclohexyl)methylamino]-N-propan-2-ylacetamide (PubChem CID 64911813) has the molecular formula C12H24N2O2 and a molecular weight of 228.34 g/mol. Its IUPAC name is 2-[(2-hydroxycyclohexyl)methylamino]-N-propan-2-ylacetamide.

Molecular Properties

Compound Name2-[(2-hydroxycyclohexyl)methylamino]-N-propan-2-ylacetamide
PubChem CID64911813
Molecular FormulaC12H24N2O2
Molecular Weight228.34 g/mol
Exact Mass228.18
IUPAC Name2-[(2-hydroxycyclohexyl)methylamino]-N-propan-2-ylacetamide
SMILESCC(C)NC(=O)CNCC1CCCCC1O
InChIInChI=1S/C12H24N2O2/c1-9(2)14-12(16)8-13-7-10-5-3-4-6-11(10)15/h9-11,13,15H,3-8H2,1-2H3,(H,14,16)
InChIKeyREUJXPJLFNEUPP-UHFFFAOYSA-N
XLogP0.65
TPSA61.36 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500228.34
LogP ≤ 50.65
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

2-[(2-hydroxycyclohexyl)methylamino]-N-(2-methoxyethyl)acetamide
CID 64913466
2-[(2-hydroxycyclohexyl)methylamino]-N-(4-methylphenyl)acetamide
CID 64911376
2-[(3-hydroxycyclobutyl)methylamino]-N-propan-2-ylacetamide
CID 66005704
2-(cyclopropylmethylamino)-N-[(2-hydroxycyclohexyl)methyl]acetamide;hydrochloride
CID 119795423
3-[(2-hydroxycyclohexyl)methylamino]butanoic acid
CID 64911182
2-[[(1R,2R)-2-hydroxycyclohexyl]methylamino]-N-(2-methyl-6-propan-2-ylphenyl)acetamide
CID 50959258
N-cyclopentyl-2-[[2-oxo-2-(propan-2-ylamino)ethyl]amino]acetamide
CID 43402010
N-(cyclopropylmethyl)-2-[[2-oxo-2-(propan-2-ylamino)ethyl]amino]acetamide
CID 43567877
N-[(2-hydroxycyclohexyl)methyl]-2-(methylamino)acetamide
CID 64912652
2-[[(2-hydroxycyclopentyl)methylamino]methyl]prop-2-enoic acid
CID 103255182
2-chloro-N-[(2-hydroxycyclohexyl)methyl]propanamide
CID 64929109
(2R)-2-amino-N-[(2-hydroxycyclohexyl)methyl]propanamide
CID 79001441

Frequently Asked Questions

What is the IUPAC name of 2-[(2-hydroxycyclohexyl)methylamino]-N-propan-2-ylacetamide?
The IUPAC name of 2-[(2-hydroxycyclohexyl)methylamino]-N-propan-2-ylacetamide (CID 64911813) is 2-[(2-hydroxycyclohexyl)methylamino]-N-propan-2-ylacetamide.
What is the SMILES notation for 2-[(2-hydroxycyclohexyl)methylamino]-N-propan-2-ylacetamide?
The canonical SMILES for 2-[(2-hydroxycyclohexyl)methylamino]-N-propan-2-ylacetamide is CC(C)NC(=O)CNCC1CCCCC1O.
What is the InChIKey of 2-[(2-hydroxycyclohexyl)methylamino]-N-propan-2-ylacetamide?
The InChIKey is REUJXPJLFNEUPP-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H24N2O2/c1-9(2)14-12(16)8-13-7-10-5-3-4-6-11(10)15/h9-11,13,15H,3-8H2,1-2H3,(H,14,16).
What are the key properties of 2-[(2-hydroxycyclohexyl)methylamino]-N-propan-2-ylacetamide?
2-[(2-hydroxycyclohexyl)methylamino]-N-propan-2-ylacetamide has a molecular weight of 228.34 g/mol, XLogP of 0.65, 5 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(2-hydroxycyclohexyl)methylamino]-N-propan-2-ylacetamide is sourced from PubChem (CID 64911813), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).