N-[(1-aminocyclohexyl)methyl]-2-propan-2-yloxyacetamide

C12H24N2O2 — CID 119404527

IUPACN-[(1-aminocyclohexyl)methyl]-2-propan-2-yloxyacetamide
SMILESCC(C)OCC(=O)NCC1(N)CCCCC1
InChIInChI=1S/C12H24N2O2/c1-10(2)16-8-11(15)14-9-12(13)6-4-3-5-7-12/h10H,3-9,13H2,1-2H3,(H,14,15)
InChIKeyMNSANBMLJHIANC-UHFFFAOYSA-N
MW228.34 g/mol
LogP1.19
Rot. Bonds5

About N-[(1-aminocyclohexyl)methyl]-2-propan-2-yloxyacetamide

N-[(1-aminocyclohexyl)methyl]-2-propan-2-yloxyacetamide (PubChem CID 119404527) has the molecular formula C12H24N2O2 and a molecular weight of 228.34 g/mol. Its IUPAC name is N-[(1-aminocyclohexyl)methyl]-2-propan-2-yloxyacetamide.

Molecular Properties

Compound NameN-[(1-aminocyclohexyl)methyl]-2-propan-2-yloxyacetamide
PubChem CID119404527
Molecular FormulaC12H24N2O2
Molecular Weight228.34 g/mol
Exact Mass228.18
IUPAC NameN-[(1-aminocyclohexyl)methyl]-2-propan-2-yloxyacetamide
SMILESCC(C)OCC(=O)NCC1(N)CCCCC1
InChIInChI=1S/C12H24N2O2/c1-10(2)16-8-11(15)14-9-12(13)6-4-3-5-7-12/h10H,3-9,13H2,1-2H3,(H,14,15)
InChIKeyMNSANBMLJHIANC-UHFFFAOYSA-N
XLogP1.19
TPSA64.35 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500228.34
LogP ≤ 51.19
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-[(1-aminocyclohexyl)methyl]-2-propan-2-yloxyacetamide;hydrochloride
CID 119404526
N-[[1-(aminomethyl)cyclopropyl]methyl]-2-propan-2-yloxyacetamide
CID 112604289
N-[(1-aminocyclohexyl)methyl]-2-(2-methoxyethoxy)acetamide;hydrochloride
CID 119404560
N-[(1-aminocyclopropyl)methyl]-2-methoxyacetamide
CID 165463023
N-[[1-(2-methoxyethyl)cyclopropyl]methyl]-2-propan-2-yloxyacetamide
CID 103800058
(1-aminocyclohexyl)methylurea
CID 61298669
N-[1-(aminomethyl)cyclopentyl]-2-propan-2-yloxyacetamide
CID 112701354
N-[(1-aminocyclohexyl)methyl]-2-methyl-3-methylsulfanylpropanamide
CID 119404176
N-[(1-aminocyclohexyl)methyl]-1-methylcyclopentane-1-carboxamide
CID 119404713
(2S)-2-amino-N-[(1-aminocyclobutyl)methyl]propanamide
CID 130736337
N-carbamoyl-2-propan-2-yloxyacetamide
CID 112604296
N-(2-aminopropyl)-2-propan-2-yloxyacetamide
CID 112603386

Frequently Asked Questions

What is the IUPAC name of N-[(1-aminocyclohexyl)methyl]-2-propan-2-yloxyacetamide?
The IUPAC name of N-[(1-aminocyclohexyl)methyl]-2-propan-2-yloxyacetamide (CID 119404527) is N-[(1-aminocyclohexyl)methyl]-2-propan-2-yloxyacetamide.
What is the SMILES notation for N-[(1-aminocyclohexyl)methyl]-2-propan-2-yloxyacetamide?
The canonical SMILES for N-[(1-aminocyclohexyl)methyl]-2-propan-2-yloxyacetamide is CC(C)OCC(=O)NCC1(N)CCCCC1.
What is the InChIKey of N-[(1-aminocyclohexyl)methyl]-2-propan-2-yloxyacetamide?
The InChIKey is MNSANBMLJHIANC-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H24N2O2/c1-10(2)16-8-11(15)14-9-12(13)6-4-3-5-7-12/h10H,3-9,13H2,1-2H3,(H,14,15).
What are the key properties of N-[(1-aminocyclohexyl)methyl]-2-propan-2-yloxyacetamide?
N-[(1-aminocyclohexyl)methyl]-2-propan-2-yloxyacetamide has a molecular weight of 228.34 g/mol, XLogP of 1.19, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(1-aminocyclohexyl)methyl]-2-propan-2-yloxyacetamide is sourced from PubChem (CID 119404527), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).