1-amino-N-[(4-methyloxan-4-yl)methyl]cyclopropane-1-carboxamide

C11H20N2O2 — CID 103812923

IUPAC1-amino-N-[(4-methyloxan-4-yl)methyl]cyclopropane-1-carboxamide
SMILESCC1(CNC(=O)C2(N)CC2)CCOCC1
InChIInChI=1S/C11H20N2O2/c1-10(4-6-15-7-5-10)8-13-9(14)11(12)2-3-11/h2-8,12H2,1H3,(H,13,14)
InChIKeyUNRBEHDOUWFYMN-UHFFFAOYSA-N
MW212.29 g/mol
LogP0.41
Rot. Bonds3

About 1-amino-N-[(4-methyloxan-4-yl)methyl]cyclopropane-1-carboxamide

1-amino-N-[(4-methyloxan-4-yl)methyl]cyclopropane-1-carboxamide (PubChem CID 103812923) has the molecular formula C11H20N2O2 and a molecular weight of 212.29 g/mol. Its IUPAC name is 1-amino-N-[(4-methyloxan-4-yl)methyl]cyclopropane-1-carboxamide.

Molecular Properties

Compound Name1-amino-N-[(4-methyloxan-4-yl)methyl]cyclopropane-1-carboxamide
PubChem CID103812923
Molecular FormulaC11H20N2O2
Molecular Weight212.29 g/mol
Exact Mass212.15
IUPAC Name1-amino-N-[(4-methyloxan-4-yl)methyl]cyclopropane-1-carboxamide
SMILESCC1(CNC(=O)C2(N)CC2)CCOCC1
InChIInChI=1S/C11H20N2O2/c1-10(4-6-15-7-5-10)8-13-9(14)11(12)2-3-11/h2-8,12H2,1H3,(H,13,14)
InChIKeyUNRBEHDOUWFYMN-UHFFFAOYSA-N
XLogP0.41
TPSA64.35 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500212.29
LogP ≤ 50.41
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-methyl-N-[[4-(2-methylbutanoylamino)oxan-4-yl]methyl]butanamide
CID 56790354
N-[(1S)-2,2-dimethylcyclopropyl]-4-(fluoromethyl)oxane-4-carboxamide
CID 126790819
2-[(4-methyloxan-4-yl)methylamino]-N-(2,2,2-trifluoroethyl)propanamide
CID 103742229
2-amino-3,3,3-trifluoro-N-[[1-(2-methoxyethyl)cyclopropyl]methyl]-2-methylpropanamide
CID 105791417
2-amino-3,3,3-trifluoro-2-methyl-N-[(4-methyloxan-4-yl)methyl]propanamide
CID 105891810
3-methyl-N-[[4-(3-methylbutanoylamino)oxan-4-yl]methyl]butanamide
CID 56790353
N-(1-aminopropan-2-yl)oxane-4-carboxamide
CID 19797577
N-[(2R)-1-aminopropan-2-yl]oxane-4-carboxamide
CID 54071869
N-[(2S)-1-aminopropan-2-yl]oxane-4-carboxamide
CID 54071870
Tert-butyl-[4-(methylcarbamoyl)oxan-4-yl]azanium
CID 59078589
4-(tert-butylamino)-N-methyloxane-4-carboxamide
CID 59078590
4-(Propylamino)oxane-4-carboxamide
CID 60796528

Frequently Asked Questions

What is the IUPAC name of 1-amino-N-[(4-methyloxan-4-yl)methyl]cyclopropane-1-carboxamide?
The IUPAC name of 1-amino-N-[(4-methyloxan-4-yl)methyl]cyclopropane-1-carboxamide (CID 103812923) is 1-amino-N-[(4-methyloxan-4-yl)methyl]cyclopropane-1-carboxamide.
What is the SMILES notation for 1-amino-N-[(4-methyloxan-4-yl)methyl]cyclopropane-1-carboxamide?
The canonical SMILES for 1-amino-N-[(4-methyloxan-4-yl)methyl]cyclopropane-1-carboxamide is CC1(CNC(=O)C2(N)CC2)CCOCC1.
What is the InChIKey of 1-amino-N-[(4-methyloxan-4-yl)methyl]cyclopropane-1-carboxamide?
The InChIKey is UNRBEHDOUWFYMN-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H20N2O2/c1-10(4-6-15-7-5-10)8-13-9(14)11(12)2-3-11/h2-8,12H2,1H3,(H,13,14).
What are the key properties of 1-amino-N-[(4-methyloxan-4-yl)methyl]cyclopropane-1-carboxamide?
1-amino-N-[(4-methyloxan-4-yl)methyl]cyclopropane-1-carboxamide has a molecular weight of 212.29 g/mol, XLogP of 0.41, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-amino-N-[(4-methyloxan-4-yl)methyl]cyclopropane-1-carboxamide is sourced from PubChem (CID 103812923), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).