2,2-dimethyl-N-(2-methylpropyl)-5-(oxolan-2-yl)pentan-1-amine

C15H31NO — CID 65166612

IUPAC2,2-dimethyl-N-(2-methylpropyl)-5-(oxolan-2-yl)pentan-1-amine
SMILESCC(C)CNCC(C)(C)CCCC1CCCO1
InChIInChI=1S/C15H31NO/c1-13(2)11-16-12-15(3,4)9-5-7-14-8-6-10-17-14/h13-14,16H,5-12H2,1-4H3
InChIKeyQDVYYRJBTMZCMX-UHFFFAOYSA-N
MW241.42 g/mol
LogP3.61
Rot. Bonds8

About 2,2-dimethyl-N-(2-methylpropyl)-5-(oxolan-2-yl)pentan-1-amine

2,2-dimethyl-N-(2-methylpropyl)-5-(oxolan-2-yl)pentan-1-amine (PubChem CID 65166612) has the molecular formula C15H31NO and a molecular weight of 241.42 g/mol. Its IUPAC name is 2,2-dimethyl-N-(2-methylpropyl)-5-(oxolan-2-yl)pentan-1-amine.

Molecular Properties

Compound Name2,2-dimethyl-N-(2-methylpropyl)-5-(oxolan-2-yl)pentan-1-amine
PubChem CID65166612
Molecular FormulaC15H31NO
Molecular Weight241.42 g/mol
Exact Mass241.24
IUPAC Name2,2-dimethyl-N-(2-methylpropyl)-5-(oxolan-2-yl)pentan-1-amine
SMILESCC(C)CNCC(C)(C)CCCC1CCCO1
InChIInChI=1S/C15H31NO/c1-13(2)11-16-12-15(3,4)9-5-7-14-8-6-10-17-14/h13-14,16H,5-12H2,1-4H3
InChIKeyQDVYYRJBTMZCMX-UHFFFAOYSA-N
XLogP3.61
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds8
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500241.42
LogP ≤ 53.61
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-methyl-3-(5-methyloxolan-2-yl)-N-(2,2,2-trifluoroethyl)propan-1-amine
CID 103139099
4-[1-Fluoro-3-(oxolan-2-yl)propyl]piperidine
CID 112563841
3-[2-Fluoro-5-(oxolan-2-yl)pentan-2-yl]piperidine
CID 112564774
3-[2-Fluoro-4-(oxolan-2-yl)butan-2-yl]piperidine
CID 112564958
3-[1-Fluoro-3-(oxolan-2-yl)propyl]piperidine
CID 112565493
3-(5,5-dimethyloxolan-2-yl)-2-methyl-N-(2,2,2-trifluoroethyl)propan-1-amine
CID 113648573
2-methyl-5-(oxolan-2-yl)-N-(2,2,2-trifluoroethyl)pentan-1-amine
CID 113648584
2-methyl-4-(oxolan-2-yl)-N-(2,2,2-trifluoroethyl)butan-1-amine
CID 114899404
3-(5-Hexoxypentyl)pyrrolidine
CID 53671543
(3S)-3-[(4R)-4-methoxy-4-methylhexyl]pyrrolidine
CID 70223348
4-(5-Methyloxolan-2-yl)piperidine
CID 82839404
N-ethyl-2-methyl-4-(oxolan-2-yl)butan-2-amine
CID 91054537

Frequently Asked Questions

What is the IUPAC name of 2,2-dimethyl-N-(2-methylpropyl)-5-(oxolan-2-yl)pentan-1-amine?
The IUPAC name of 2,2-dimethyl-N-(2-methylpropyl)-5-(oxolan-2-yl)pentan-1-amine (CID 65166612) is 2,2-dimethyl-N-(2-methylpropyl)-5-(oxolan-2-yl)pentan-1-amine.
What is the SMILES notation for 2,2-dimethyl-N-(2-methylpropyl)-5-(oxolan-2-yl)pentan-1-amine?
The canonical SMILES for 2,2-dimethyl-N-(2-methylpropyl)-5-(oxolan-2-yl)pentan-1-amine is CC(C)CNCC(C)(C)CCCC1CCCO1.
What is the InChIKey of 2,2-dimethyl-N-(2-methylpropyl)-5-(oxolan-2-yl)pentan-1-amine?
The InChIKey is QDVYYRJBTMZCMX-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H31NO/c1-13(2)11-16-12-15(3,4)9-5-7-14-8-6-10-17-14/h13-14,16H,5-12H2,1-4H3.
What are the key properties of 2,2-dimethyl-N-(2-methylpropyl)-5-(oxolan-2-yl)pentan-1-amine?
2,2-dimethyl-N-(2-methylpropyl)-5-(oxolan-2-yl)pentan-1-amine has a molecular weight of 241.42 g/mol, XLogP of 3.61, 8 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2,2-dimethyl-N-(2-methylpropyl)-5-(oxolan-2-yl)pentan-1-amine is sourced from PubChem (CID 65166612), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).