4-methyl-1-(oxolan-2-yl)-4-piperidin-1-ylpentan-3-amine

C15H30N2O — CID 79044940

IUPAC4-methyl-1-(oxolan-2-yl)-4-piperidin-1-ylpentan-3-amine
SMILESCC(C)(C(N)CCC1CCCO1)N1CCCCC1
InChIInChI=1S/C15H30N2O/c1-15(2,17-10-4-3-5-11-17)14(16)9-8-13-7-6-12-18-13/h13-14H,3-12,16H2,1-2H3
InChIKeyNWGRYPPRXQVVGH-UHFFFAOYSA-N
MW254.42 g/mol
LogP2.54
Rot. Bonds5

About 4-methyl-1-(oxolan-2-yl)-4-piperidin-1-ylpentan-3-amine

4-methyl-1-(oxolan-2-yl)-4-piperidin-1-ylpentan-3-amine (PubChem CID 79044940) has the molecular formula C15H30N2O and a molecular weight of 254.42 g/mol. Its IUPAC name is 4-methyl-1-(oxolan-2-yl)-4-piperidin-1-ylpentan-3-amine.

Molecular Properties

Compound Name4-methyl-1-(oxolan-2-yl)-4-piperidin-1-ylpentan-3-amine
PubChem CID79044940
Molecular FormulaC15H30N2O
Molecular Weight254.42 g/mol
Exact Mass254.24
IUPAC Name4-methyl-1-(oxolan-2-yl)-4-piperidin-1-ylpentan-3-amine
SMILESCC(C)(C(N)CCC1CCCO1)N1CCCCC1
InChIInChI=1S/C15H30N2O/c1-15(2,17-10-4-3-5-11-17)14(16)9-8-13-7-6-12-18-13/h13-14H,3-12,16H2,1-2H3
InChIKeyNWGRYPPRXQVVGH-UHFFFAOYSA-N
XLogP2.54
TPSA38.49 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500254.42
LogP ≤ 52.54
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

4-(azepan-1-yl)-4-methyl-1-(oxolan-2-yl)pentan-3-ol
CID 79051804
4-(azepan-1-yl)-N-ethyl-4-methyl-1-(oxolan-2-yl)pentan-3-amine
CID 79050801
5-methyl-1-(oxolan-2-yl)-5-piperidin-1-ylheptan-4-amine
CID 79065672
(2R)-4-[(2R)-oxolan-2-yl]butan-2-amine
CID 7380763
1,5-bis(oxolan-2-yl)pentan-3-amine
CID 104993652
N-ethyl-4-methyl-4-morpholin-4-yl-1-(oxolan-2-yl)pentan-3-amine
CID 79050892
1-(oxolan-2-yl)pentan-3-amine
CID 62549637
1-methylsulfanyl-4-(oxolan-2-yl)butan-2-amine
CID 65164455
4-methyl-3-[2-(oxolan-2-yl)ethyl]pentan-2-amine
CID 65161981
6,6-dimethyl-1-(oxan-2-yl)heptan-3-amine
CID 115849890
1,1-difluoro-4-(oxolan-2-yl)butan-2-amine
CID 103516728
5,5-dimethyl-1-(oxolan-2-yl)hexane-3,4-diol
CID 103457082

Frequently Asked Questions

What is the IUPAC name of 4-methyl-1-(oxolan-2-yl)-4-piperidin-1-ylpentan-3-amine?
The IUPAC name of 4-methyl-1-(oxolan-2-yl)-4-piperidin-1-ylpentan-3-amine (CID 79044940) is 4-methyl-1-(oxolan-2-yl)-4-piperidin-1-ylpentan-3-amine.
What is the SMILES notation for 4-methyl-1-(oxolan-2-yl)-4-piperidin-1-ylpentan-3-amine?
The canonical SMILES for 4-methyl-1-(oxolan-2-yl)-4-piperidin-1-ylpentan-3-amine is CC(C)(C(N)CCC1CCCO1)N1CCCCC1.
What is the InChIKey of 4-methyl-1-(oxolan-2-yl)-4-piperidin-1-ylpentan-3-amine?
The InChIKey is NWGRYPPRXQVVGH-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H30N2O/c1-15(2,17-10-4-3-5-11-17)14(16)9-8-13-7-6-12-18-13/h13-14H,3-12,16H2,1-2H3.
What are the key properties of 4-methyl-1-(oxolan-2-yl)-4-piperidin-1-ylpentan-3-amine?
4-methyl-1-(oxolan-2-yl)-4-piperidin-1-ylpentan-3-amine has a molecular weight of 254.42 g/mol, XLogP of 2.54, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methyl-1-(oxolan-2-yl)-4-piperidin-1-ylpentan-3-amine is sourced from PubChem (CID 79044940), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).