N-(2-methylpropyl)-5-(oxolan-2-yl)-2-propylpentan-1-amine

C16H33NO — CID 65166550

IUPACN-(2-methylpropyl)-5-(oxolan-2-yl)-2-propylpentan-1-amine
SMILESCCCC(CCCC1CCCO1)CNCC(C)C
InChIInChI=1S/C16H33NO/c1-4-7-15(13-17-12-14(2)3)8-5-9-16-10-6-11-18-16/h14-17H,4-13H2,1-3H3
InChIKeyOUNGEIPMHTYUKO-UHFFFAOYSA-N
MW255.45 g/mol
LogP4.00
Rot. Bonds10

About N-(2-methylpropyl)-5-(oxolan-2-yl)-2-propylpentan-1-amine

N-(2-methylpropyl)-5-(oxolan-2-yl)-2-propylpentan-1-amine (PubChem CID 65166550) has the molecular formula C16H33NO and a molecular weight of 255.45 g/mol. Its IUPAC name is N-(2-methylpropyl)-5-(oxolan-2-yl)-2-propylpentan-1-amine.

Molecular Properties

Compound NameN-(2-methylpropyl)-5-(oxolan-2-yl)-2-propylpentan-1-amine
PubChem CID65166550
Molecular FormulaC16H33NO
Molecular Weight255.45 g/mol
Exact Mass255.26
IUPAC NameN-(2-methylpropyl)-5-(oxolan-2-yl)-2-propylpentan-1-amine
SMILESCCCC(CCCC1CCCO1)CNCC(C)C
InChIInChI=1S/C16H33NO/c1-4-7-15(13-17-12-14(2)3)8-5-9-16-10-6-11-18-16/h14-17H,4-13H2,1-3H3
InChIKeyOUNGEIPMHTYUKO-UHFFFAOYSA-N
XLogP4.00
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds10
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500255.45
LogP ≤ 54.00
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

5-(oxolan-2-yl)-2-propylpentan-1-ol
CID 66058975
2-methyl-N-(2-methylpropyl)-4-(oxolan-2-yl)butan-1-amine
CID 64664189
2-ethyl-N-[3-(oxolan-2-yl)propyl]hexan-1-amine
CID 104668425
1-(oxolan-2-yl)octane-4,5-diol
CID 103454832
2-[4-(chloromethyl)hexyl]oxolane
CID 66034557
N-(2-methylpropyl)-2-propylheptan-1-amine
CID 63523290
2-methyl-N-[[2-[3-(oxolan-2-yl)propyl]cycloheptyl]methyl]propan-1-amine
CID 81033452
2-methyl-N-[[1-[3-(oxolan-2-yl)propyl]piperidin-4-yl]methyl]propan-1-amine
CID 65161458
2-(5-chloro-4-methylheptyl)oxolane
CID 65165898
N,5,6-trimethyl-1-(oxolan-2-yl)heptan-4-amine
CID 104993166
2-methyl-N-[[3-[3-(oxolan-2-yl)propyl]oxolan-3-yl]methyl]propan-1-amine
CID 65164937
2-[4-[5-(oxolan-2-yl)pentan-2-ylsulfanyl]pentyl]oxolane
CID 54448834

Frequently Asked Questions

What is the IUPAC name of N-(2-methylpropyl)-5-(oxolan-2-yl)-2-propylpentan-1-amine?
The IUPAC name of N-(2-methylpropyl)-5-(oxolan-2-yl)-2-propylpentan-1-amine (CID 65166550) is N-(2-methylpropyl)-5-(oxolan-2-yl)-2-propylpentan-1-amine.
What is the SMILES notation for N-(2-methylpropyl)-5-(oxolan-2-yl)-2-propylpentan-1-amine?
The canonical SMILES for N-(2-methylpropyl)-5-(oxolan-2-yl)-2-propylpentan-1-amine is CCCC(CCCC1CCCO1)CNCC(C)C.
What is the InChIKey of N-(2-methylpropyl)-5-(oxolan-2-yl)-2-propylpentan-1-amine?
The InChIKey is OUNGEIPMHTYUKO-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H33NO/c1-4-7-15(13-17-12-14(2)3)8-5-9-16-10-6-11-18-16/h14-17H,4-13H2,1-3H3.
What are the key properties of N-(2-methylpropyl)-5-(oxolan-2-yl)-2-propylpentan-1-amine?
N-(2-methylpropyl)-5-(oxolan-2-yl)-2-propylpentan-1-amine has a molecular weight of 255.45 g/mol, XLogP of 4.00, 10 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-methylpropyl)-5-(oxolan-2-yl)-2-propylpentan-1-amine is sourced from PubChem (CID 65166550), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).