1-cyclopropyl-2-methoxy-N,3-dimethylbutan-1-amine

C10H21NO — CID 116720061

IUPAC1-cyclopropyl-2-methoxy-N,3-dimethylbutan-1-amine
SMILESCNC(C1CC1)C(OC)C(C)C
InChIInChI=1S/C10H21NO/c1-7(2)10(12-4)9(11-3)8-5-6-8/h7-11H,5-6H2,1-4H3
InChIKeyWVPOMEOMNCZUSD-UHFFFAOYSA-N
MW171.28 g/mol
LogP1.66
Rot. Bonds5

About 1-cyclopropyl-2-methoxy-N,3-dimethylbutan-1-amine

1-cyclopropyl-2-methoxy-N,3-dimethylbutan-1-amine (PubChem CID 116720061) has the molecular formula C10H21NO and a molecular weight of 171.28 g/mol. Its IUPAC name is 1-cyclopropyl-2-methoxy-N,3-dimethylbutan-1-amine.

Molecular Properties

Compound Name1-cyclopropyl-2-methoxy-N,3-dimethylbutan-1-amine
PubChem CID116720061
Molecular FormulaC10H21NO
Molecular Weight171.28 g/mol
Exact Mass171.16
IUPAC Name1-cyclopropyl-2-methoxy-N,3-dimethylbutan-1-amine
SMILESCNC(C1CC1)C(OC)C(C)C
InChIInChI=1S/C10H21NO/c1-7(2)10(12-4)9(11-3)8-5-6-8/h7-11H,5-6H2,1-4H3
InChIKeyWVPOMEOMNCZUSD-UHFFFAOYSA-N
XLogP1.66
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500171.28
LogP ≤ 51.66
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1-cyclopentyl-2-methoxy-N-methylpropan-1-amine
CID 79616561
1-(4-ethylcyclohexyl)-2-methoxy-3-methyl-N-propylbutan-1-amine
CID 116720650
2-methoxy-N,3-dimethyl-1-(2-phenylcyclopropyl)butan-1-amine
CID 116719956
4-[2-methyl-1-(methylamino)propyl]cyclohexan-1-amine
CID 116952267
N,2-dimethyl-1-(4-propan-2-ylcycloheptyl)propan-1-amine
CID 79299262
N,2-dimethyl-1-(4-propan-2-ylcyclohexyl)butan-1-amine
CID 79446345
1-(3,4-dimethylcyclohexyl)-2-methoxy-3-methyl-N-propylbutan-1-amine
CID 116720679
1,2-dicyclohexyl-2-methoxy-N-methylethanamine
CID 116771418
1-cyclobutyl-N,2,3-trimethylbutan-1-amine
CID 105049433
1-(4-cyclopropyloxyphenyl)-2-methoxy-N,3-dimethylbutan-1-amine
CID 114519800
3,4,5-trimethoxy-2,6-dimethylheptane
CID 58100186
2-methoxy-N-methyl-1-(4-methylcyclohexyl)-2-phenylethanamine
CID 116772639

Frequently Asked Questions

What is the IUPAC name of 1-cyclopropyl-2-methoxy-N,3-dimethylbutan-1-amine?
The IUPAC name of 1-cyclopropyl-2-methoxy-N,3-dimethylbutan-1-amine (CID 116720061) is 1-cyclopropyl-2-methoxy-N,3-dimethylbutan-1-amine.
What is the SMILES notation for 1-cyclopropyl-2-methoxy-N,3-dimethylbutan-1-amine?
The canonical SMILES for 1-cyclopropyl-2-methoxy-N,3-dimethylbutan-1-amine is CNC(C1CC1)C(OC)C(C)C.
What is the InChIKey of 1-cyclopropyl-2-methoxy-N,3-dimethylbutan-1-amine?
The InChIKey is WVPOMEOMNCZUSD-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H21NO/c1-7(2)10(12-4)9(11-3)8-5-6-8/h7-11H,5-6H2,1-4H3.
What are the key properties of 1-cyclopropyl-2-methoxy-N,3-dimethylbutan-1-amine?
1-cyclopropyl-2-methoxy-N,3-dimethylbutan-1-amine has a molecular weight of 171.28 g/mol, XLogP of 1.66, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclopropyl-2-methoxy-N,3-dimethylbutan-1-amine is sourced from PubChem (CID 116720061), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).