N-(2-cyclopropylpropan-2-yl)-4-methoxybutan-2-amine

C11H23NO — CID 103931910

IUPACN-(2-cyclopropylpropan-2-yl)-4-methoxybutan-2-amine
SMILESCOCCC(C)NC(C)(C)C1CC1
InChIInChI=1S/C11H23NO/c1-9(7-8-13-4)12-11(2,3)10-5-6-10/h9-10,12H,5-8H2,1-4H3
InChIKeyITJPGKNBZZHROE-UHFFFAOYSA-N
MW185.31 g/mol
LogP2.19
Rot. Bonds6

About N-(2-cyclopropylpropan-2-yl)-4-methoxybutan-2-amine

N-(2-cyclopropylpropan-2-yl)-4-methoxybutan-2-amine (PubChem CID 103931910) has the molecular formula C11H23NO and a molecular weight of 185.31 g/mol. Its IUPAC name is N-(2-cyclopropylpropan-2-yl)-4-methoxybutan-2-amine.

Molecular Properties

Compound NameN-(2-cyclopropylpropan-2-yl)-4-methoxybutan-2-amine
PubChem CID103931910
Molecular FormulaC11H23NO
Molecular Weight185.31 g/mol
Exact Mass185.18
IUPAC NameN-(2-cyclopropylpropan-2-yl)-4-methoxybutan-2-amine
SMILESCOCCC(C)NC(C)(C)C1CC1
InChIInChI=1S/C11H23NO/c1-9(7-8-13-4)12-11(2,3)10-5-6-10/h9-10,12H,5-8H2,1-4H3
InChIKeyITJPGKNBZZHROE-UHFFFAOYSA-N
XLogP2.19
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500185.31
LogP ≤ 52.19
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-(4-methoxybutan-2-ylamino)-2-methylpropan-1-ol
CID 115595179
3-(4-methoxybutan-2-ylamino)-2,3-dimethylbutan-2-ol
CID 106185432
N-(4-methoxybutan-2-yl)-2-methylpentan-2-amine
CID 115920019
N-(4-methoxybutan-2-yl)-2-methylbut-3-yn-2-amine
CID 63998115
N-(3-cyclopropylpropyl)-4-methoxybutan-2-amine
CID 115688384
2-(hydroxymethyl)-2-(4-methoxybutan-2-ylamino)propane-1,3-diol
CID 107850471
N-(2-cyclopentylpropan-2-yl)-1-cyclopropylpropan-2-amine
CID 115922765
N-[(1S)-1-cyclopentylethyl]-4-methoxybutan-2-amine
CID 81385535
2-(2-cyclopropylpropan-2-ylamino)propanamide
CID 104577813
N-(4-methoxybutan-2-yl)-1-azabicyclo[3.2.1]octan-4-amine
CID 105364641
2-cyclopropyl-2-fluoro-5-methoxy-3-methylpentan-1-amine
CID 116500631
2-cyclohexyl-5-methoxy-3-methylpentan-2-ol
CID 114795055

Frequently Asked Questions

What is the IUPAC name of N-(2-cyclopropylpropan-2-yl)-4-methoxybutan-2-amine?
The IUPAC name of N-(2-cyclopropylpropan-2-yl)-4-methoxybutan-2-amine (CID 103931910) is N-(2-cyclopropylpropan-2-yl)-4-methoxybutan-2-amine.
What is the SMILES notation for N-(2-cyclopropylpropan-2-yl)-4-methoxybutan-2-amine?
The canonical SMILES for N-(2-cyclopropylpropan-2-yl)-4-methoxybutan-2-amine is COCCC(C)NC(C)(C)C1CC1.
What is the InChIKey of N-(2-cyclopropylpropan-2-yl)-4-methoxybutan-2-amine?
The InChIKey is ITJPGKNBZZHROE-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H23NO/c1-9(7-8-13-4)12-11(2,3)10-5-6-10/h9-10,12H,5-8H2,1-4H3.
What are the key properties of N-(2-cyclopropylpropan-2-yl)-4-methoxybutan-2-amine?
N-(2-cyclopropylpropan-2-yl)-4-methoxybutan-2-amine has a molecular weight of 185.31 g/mol, XLogP of 2.19, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-cyclopropylpropan-2-yl)-4-methoxybutan-2-amine is sourced from PubChem (CID 103931910), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).