3-cyclopropyl-N-methyl-N-propan-2-ylbutan-1-amine

C11H23N — CID 177203933

IUPAC3-cyclopropyl-N-methyl-N-propan-2-ylbutan-1-amine
SMILESCC(CCN(C)C(C)C)C1CC1
InChIInChI=1S/C11H23N/c1-9(2)12(4)8-7-10(3)11-5-6-11/h9-11H,5-8H2,1-4H3
InChIKeyKTIRNFKVKKEKTG-UHFFFAOYSA-N
MW169.31 g/mol
LogP2.76
Rot. Bonds5

About 3-cyclopropyl-N-methyl-N-propan-2-ylbutan-1-amine

3-cyclopropyl-N-methyl-N-propan-2-ylbutan-1-amine (PubChem CID 177203933) has the molecular formula C11H23N and a molecular weight of 169.31 g/mol. Its IUPAC name is 3-cyclopropyl-N-methyl-N-propan-2-ylbutan-1-amine.

Molecular Properties

Compound Name3-cyclopropyl-N-methyl-N-propan-2-ylbutan-1-amine
PubChem CID177203933
Molecular FormulaC11H23N
Molecular Weight169.31 g/mol
Exact Mass169.18
IUPAC Name3-cyclopropyl-N-methyl-N-propan-2-ylbutan-1-amine
SMILESCC(CCN(C)C(C)C)C1CC1
InChIInChI=1S/C11H23N/c1-9(2)12(4)8-7-10(3)11-5-6-11/h9-11H,5-8H2,1-4H3
InChIKeyKTIRNFKVKKEKTG-UHFFFAOYSA-N
XLogP2.76
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds5
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500169.31
LogP ≤ 52.76
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

N-(2-cyclobutylethyl)-N-methylpropan-2-amine
CID 117044257
N-methyl-N-[2-(1-methylpiperidin-3-yl)ethyl]propan-2-amine
CID 117044255
N-(1-cyclopropylpropyl)-N'-methyl-N'-propan-2-ylpropane-1,3-diamine
CID 115708770
3-(cyclopropylmethyl)-5-[methyl(propan-2-yl)amino]pentane-1-sulfinate
CID 166686827
(3R)-N,3-dimethyl-N-propan-2-ylpentan-1-amine;hydrofluoride
CID 176934799
(3S)-N,3,5-trimethyl-N-propan-2-ylhexan-1-amine
CID 158122452
3-cyclopentyl-N-methyl-N-propan-2-ylpropan-1-amine
CID 21034246
N-(cyclopropylmethyl)-N'-methyl-N'-propan-2-ylethane-1,2-diamine
CID 60867294
N-(cyclohexylmethyl)-N-methylpropan-2-amine
CID 18711540
4,4,4-trifluoro-N,3-dimethyl-N-propan-2-ylbutan-1-amine
CID 143734656
octan-2-ylcyclopropane
CID 18968125
bis(N-(cyclopropylmethyl)-N-methylpropan-2-amine);bis(3-methylbutylcyclopropane)
CID 167643332

Frequently Asked Questions

What is the IUPAC name of 3-cyclopropyl-N-methyl-N-propan-2-ylbutan-1-amine?
The IUPAC name of 3-cyclopropyl-N-methyl-N-propan-2-ylbutan-1-amine (CID 177203933) is 3-cyclopropyl-N-methyl-N-propan-2-ylbutan-1-amine.
What is the SMILES notation for 3-cyclopropyl-N-methyl-N-propan-2-ylbutan-1-amine?
The canonical SMILES for 3-cyclopropyl-N-methyl-N-propan-2-ylbutan-1-amine is CC(CCN(C)C(C)C)C1CC1.
What is the InChIKey of 3-cyclopropyl-N-methyl-N-propan-2-ylbutan-1-amine?
The InChIKey is KTIRNFKVKKEKTG-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H23N/c1-9(2)12(4)8-7-10(3)11-5-6-11/h9-11H,5-8H2,1-4H3.
What are the key properties of 3-cyclopropyl-N-methyl-N-propan-2-ylbutan-1-amine?
3-cyclopropyl-N-methyl-N-propan-2-ylbutan-1-amine has a molecular weight of 169.31 g/mol, XLogP of 2.76, 5 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 3-cyclopropyl-N-methyl-N-propan-2-ylbutan-1-amine is sourced from PubChem (CID 177203933), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).