2-cyclopropyl-2-methyl-4-(oxolan-2-yl)-N-propan-2-ylbutan-1-amine

C15H29NO — CID 83159333

IUPAC2-cyclopropyl-2-methyl-4-(oxolan-2-yl)-N-propan-2-ylbutan-1-amine
SMILESCC(C)NCC(C)(CCC1CCCO1)C1CC1
InChIInChI=1S/C15H29NO/c1-12(2)16-11-15(3,13-6-7-13)9-8-14-5-4-10-17-14/h12-14,16H,4-11H2,1-3H3
InChIKeyISIKKCKEWJMKKG-UHFFFAOYSA-N
MW239.40 g/mol
LogP3.36
Rot. Bonds7

About 2-cyclopropyl-2-methyl-4-(oxolan-2-yl)-N-propan-2-ylbutan-1-amine

2-cyclopropyl-2-methyl-4-(oxolan-2-yl)-N-propan-2-ylbutan-1-amine (PubChem CID 83159333) has the molecular formula C15H29NO and a molecular weight of 239.40 g/mol. Its IUPAC name is 2-cyclopropyl-2-methyl-4-(oxolan-2-yl)-N-propan-2-ylbutan-1-amine.

Molecular Properties

Compound Name2-cyclopropyl-2-methyl-4-(oxolan-2-yl)-N-propan-2-ylbutan-1-amine
PubChem CID83159333
Molecular FormulaC15H29NO
Molecular Weight239.40 g/mol
Exact Mass239.22
IUPAC Name2-cyclopropyl-2-methyl-4-(oxolan-2-yl)-N-propan-2-ylbutan-1-amine
SMILESCC(C)NCC(C)(CCC1CCCO1)C1CC1
InChIInChI=1S/C15H29NO/c1-12(2)16-11-15(3,13-6-7-13)9-8-14-5-4-10-17-14/h12-14,16H,4-11H2,1-3H3
InChIKeyISIKKCKEWJMKKG-UHFFFAOYSA-N
XLogP3.36
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500239.40
LogP ≤ 53.36
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-cyclopropyl-N-(2-methoxyethyl)-2-methyl-4-(oxolan-2-yl)butan-1-amine
CID 83160361
2-cyclopropyl-2-methyl-4-(oxolan-2-yl)butanoic acid
CID 83148663
3,3-dimethyl-N-[2-(oxolan-2-yl)ethyl]butan-2-amine
CID 115708972
2-cyclopropyl-2,4-dimethyl-N-propan-2-ylpentan-1-amine
CID 83159690
2-(5-bromo-3,3-dimethylhexyl)oxolane
CID 65165426
5-(oxolan-2-yl)-N-propan-2-ylpentan-1-amine
CID 65166491
N,3,3-trimethyl-5-(oxolan-2-yl)pentan-1-amine
CID 81022159
3,4-dimethyl-1-(oxolan-2-yl)hexan-3-ol
CID 65161696
1-(tert-butylamino)-2-methyl-4-(oxolan-2-yl)butan-2-ol
CID 66037038
N-(oxolan-2-ylmethyl)propan-2-amine;hydrochloride
CID 172772952
3-cyclohexyl-2-cyclopropyl-2-methyl-N-propan-2-ylpropan-1-amine
CID 83159871
3-cyclopropyl-1-(oxolan-2-yl)pentan-3-ol
CID 65161613

Frequently Asked Questions

What is the IUPAC name of 2-cyclopropyl-2-methyl-4-(oxolan-2-yl)-N-propan-2-ylbutan-1-amine?
The IUPAC name of 2-cyclopropyl-2-methyl-4-(oxolan-2-yl)-N-propan-2-ylbutan-1-amine (CID 83159333) is 2-cyclopropyl-2-methyl-4-(oxolan-2-yl)-N-propan-2-ylbutan-1-amine.
What is the SMILES notation for 2-cyclopropyl-2-methyl-4-(oxolan-2-yl)-N-propan-2-ylbutan-1-amine?
The canonical SMILES for 2-cyclopropyl-2-methyl-4-(oxolan-2-yl)-N-propan-2-ylbutan-1-amine is CC(C)NCC(C)(CCC1CCCO1)C1CC1.
What is the InChIKey of 2-cyclopropyl-2-methyl-4-(oxolan-2-yl)-N-propan-2-ylbutan-1-amine?
The InChIKey is ISIKKCKEWJMKKG-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H29NO/c1-12(2)16-11-15(3,13-6-7-13)9-8-14-5-4-10-17-14/h12-14,16H,4-11H2,1-3H3.
What are the key properties of 2-cyclopropyl-2-methyl-4-(oxolan-2-yl)-N-propan-2-ylbutan-1-amine?
2-cyclopropyl-2-methyl-4-(oxolan-2-yl)-N-propan-2-ylbutan-1-amine has a molecular weight of 239.40 g/mol, XLogP of 3.36, 7 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-cyclopropyl-2-methyl-4-(oxolan-2-yl)-N-propan-2-ylbutan-1-amine is sourced from PubChem (CID 83159333), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).