N,N-dimethyl-1-[3-(oxan-4-yl)-2-pyridinyl]methanamine;ethane

C15H26N2O — CID 156651522

IUPACN,N-dimethyl-1-[3-(oxan-4-yl)-2-pyridinyl]methanamine;ethane
SMILESCC.CN(C)Cc1ncccc1C1CCOCC1
InChIInChI=1S/C13H20N2O.C2H6/c1-15(2)10-13-12(4-3-7-14-13)11-5-8-16-9-6-11;1-2/h3-4,7,11H,5-6,8-10H2,1-2H3;1-2H3
InChIKeyLZRZPMHPXAXBSN-UHFFFAOYSA-N
MW250.39 g/mol
LogP3.06
Rot. Bonds3

About N,N-dimethyl-1-[3-(oxan-4-yl)-2-pyridinyl]methanamine;ethane

N,N-dimethyl-1-[3-(oxan-4-yl)-2-pyridinyl]methanamine;ethane (PubChem CID 156651522) has the molecular formula C15H26N2O and a molecular weight of 250.39 g/mol. Its IUPAC name is N,N-dimethyl-1-[3-(oxan-4-yl)-2-pyridinyl]methanamine;ethane.

Molecular Properties

Compound NameN,N-dimethyl-1-[3-(oxan-4-yl)-2-pyridinyl]methanamine;ethane
PubChem CID156651522
Molecular FormulaC15H26N2O
Molecular Weight250.39 g/mol
Exact Mass250.20
IUPAC NameN,N-dimethyl-1-[3-(oxan-4-yl)-2-pyridinyl]methanamine;ethane
SMILESCC.CN(C)Cc1ncccc1C1CCOCC1
InChIInChI=1S/C13H20N2O.C2H6/c1-15(2)10-13-12(4-3-7-14-13)11-5-8-16-9-6-11;1-2/h3-4,7,11H,5-6,8-10H2,1-2H3;1-2H3
InChIKeyLZRZPMHPXAXBSN-UHFFFAOYSA-N
XLogP3.06
TPSA25.36 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500250.39
LogP ≤ 53.06
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

N,N-dimethyl-1-(3-morpholin-4-yl-2-pyridinyl)methanamine
CID 156651806
6-[(dimethylamino)methyl]-5-[(3S)-oxolan-3-yl]pyridin-2-amine
CID 178156266
N,N-dimethyl-1-(3-methyl-2-pyridinyl)methanamine
CID 20666322
N,N-dimethyl-1-[2-(trimethylsilylmethyl)-3-pyridinyl]methanamine
CID 13058277
1-[5-bromo-3-(oxan-4-yl)thiophen-2-yl]-N,N-dimethylmethanamine
CID 165400803
3-[[methyl(oxan-4-yl)amino]methyl]pyridine-2-carboxylic acid
CID 63069334
1-(3-methoxy-2-pyridinyl)-N,N-dimethylmethanamine
CID 130666799
[3-[(dimethylamino)methyl]-2-pyridinyl]methanamine
CID 62893638
2-(aminomethyl)-N-methyl-N-(oxan-4-yl)pyridine-3-sulfonamide
CID 106593986
ethane;2,2,2-trifluoro-N-methyl-N-[[6-methyl-3-(oxolan-3-yl)-2-pyridinyl]methyl]ethanamine
CID 172576226
(3-piperidin-4-yl-2-pyridinyl)methanamine
CID 152769821
3-bromo-2-(oxan-4-yl)pyridine
CID 130058346

Frequently Asked Questions

What is the IUPAC name of N,N-dimethyl-1-[3-(oxan-4-yl)-2-pyridinyl]methanamine;ethane?
The IUPAC name of N,N-dimethyl-1-[3-(oxan-4-yl)-2-pyridinyl]methanamine;ethane (CID 156651522) is N,N-dimethyl-1-[3-(oxan-4-yl)-2-pyridinyl]methanamine;ethane.
What is the SMILES notation for N,N-dimethyl-1-[3-(oxan-4-yl)-2-pyridinyl]methanamine;ethane?
The canonical SMILES for N,N-dimethyl-1-[3-(oxan-4-yl)-2-pyridinyl]methanamine;ethane is CC.CN(C)Cc1ncccc1C1CCOCC1.
What is the InChIKey of N,N-dimethyl-1-[3-(oxan-4-yl)-2-pyridinyl]methanamine;ethane?
The InChIKey is LZRZPMHPXAXBSN-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H20N2O.C2H6/c1-15(2)10-13-12(4-3-7-14-13)11-5-8-16-9-6-11;1-2/h3-4,7,11H,5-6,8-10H2,1-2H3;1-2H3.
What are the key properties of N,N-dimethyl-1-[3-(oxan-4-yl)-2-pyridinyl]methanamine;ethane?
N,N-dimethyl-1-[3-(oxan-4-yl)-2-pyridinyl]methanamine;ethane has a molecular weight of 250.39 g/mol, XLogP of 3.06, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-dimethyl-1-[3-(oxan-4-yl)-2-pyridinyl]methanamine;ethane is sourced from PubChem (CID 156651522), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).