N-(3-cyclopropylbutan-2-yl)-4,4-dimethylpent-1-en-2-amine

C14H27N — CID 134187656

IUPACN-(3-cyclopropylbutan-2-yl)-4,4-dimethylpent-1-en-2-amine
SMILESC=C(CC(C)(C)C)NC(C)C(C)C1CC1
InChIInChI=1S/C14H27N/c1-10(9-14(4,5)6)15-12(3)11(2)13-7-8-13/h11-13,15H,1,7-9H2,2-6H3
InChIKeyOMFOWFMRDKYIDX-UHFFFAOYSA-N
MW209.38 g/mol
LogP3.96
Rot. Bonds5

About N-(3-cyclopropylbutan-2-yl)-4,4-dimethylpent-1-en-2-amine

N-(3-cyclopropylbutan-2-yl)-4,4-dimethylpent-1-en-2-amine (PubChem CID 134187656) has the molecular formula C14H27N and a molecular weight of 209.38 g/mol. Its IUPAC name is N-(3-cyclopropylbutan-2-yl)-4,4-dimethylpent-1-en-2-amine.

Molecular Properties

Compound NameN-(3-cyclopropylbutan-2-yl)-4,4-dimethylpent-1-en-2-amine
PubChem CID134187656
Molecular FormulaC14H27N
Molecular Weight209.38 g/mol
Exact Mass209.21
IUPAC NameN-(3-cyclopropylbutan-2-yl)-4,4-dimethylpent-1-en-2-amine
SMILESC=C(CC(C)(C)C)NC(C)C(C)C1CC1
InChIInChI=1S/C14H27N/c1-10(9-14(4,5)6)15-12(3)11(2)13-7-8-13/h11-13,15H,1,7-9H2,2-6H3
InChIKeyOMFOWFMRDKYIDX-UHFFFAOYSA-N
XLogP3.96
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds5
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500209.38
LogP ≤ 53.96
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of N-(3-cyclopropylbutan-2-yl)-4,4-dimethylpent-1-en-2-amine?
The IUPAC name of N-(3-cyclopropylbutan-2-yl)-4,4-dimethylpent-1-en-2-amine (CID 134187656) is N-(3-cyclopropylbutan-2-yl)-4,4-dimethylpent-1-en-2-amine.
What is the SMILES notation for N-(3-cyclopropylbutan-2-yl)-4,4-dimethylpent-1-en-2-amine?
The canonical SMILES for N-(3-cyclopropylbutan-2-yl)-4,4-dimethylpent-1-en-2-amine is C=C(CC(C)(C)C)NC(C)C(C)C1CC1.
What is the InChIKey of N-(3-cyclopropylbutan-2-yl)-4,4-dimethylpent-1-en-2-amine?
The InChIKey is OMFOWFMRDKYIDX-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H27N/c1-10(9-14(4,5)6)15-12(3)11(2)13-7-8-13/h11-13,15H,1,7-9H2,2-6H3.
What are the key properties of N-(3-cyclopropylbutan-2-yl)-4,4-dimethylpent-1-en-2-amine?
N-(3-cyclopropylbutan-2-yl)-4,4-dimethylpent-1-en-2-amine has a molecular weight of 209.38 g/mol, XLogP of 3.96, 5 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-cyclopropylbutan-2-yl)-4,4-dimethylpent-1-en-2-amine is sourced from PubChem (CID 134187656), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).