N-[[5-[[methyl-[(4-methylphenyl)methyl]amino]methyl]oxolan-2-yl]methyl]propan-2-amine

C18H30N2O — CID 62419615

IUPACN-[[5-[[methyl-[(4-methylphenyl)methyl]amino]methyl]oxolan-2-yl]methyl]propan-2-amine
SMILESCc1ccc(CN(C)CC2CCC(CNC(C)C)O2)cc1
InChIInChI=1S/C18H30N2O/c1-14(2)19-11-17-9-10-18(21-17)13-20(4)12-16-7-5-15(3)6-8-16/h5-8,14,17-19H,9-13H2,1-4H3
InChIKeyFVELHRYXUHWXCT-UHFFFAOYSA-N
MW290.45 g/mol
LogP2.97
Rot. Bonds7

About N-[[5-[[methyl-[(4-methylphenyl)methyl]amino]methyl]oxolan-2-yl]methyl]propan-2-amine

N-[[5-[[methyl-[(4-methylphenyl)methyl]amino]methyl]oxolan-2-yl]methyl]propan-2-amine (PubChem CID 62419615) has the molecular formula C18H30N2O and a molecular weight of 290.45 g/mol. Its IUPAC name is N-[[5-[[methyl-[(4-methylphenyl)methyl]amino]methyl]oxolan-2-yl]methyl]propan-2-amine.

Molecular Properties

Compound NameN-[[5-[[methyl-[(4-methylphenyl)methyl]amino]methyl]oxolan-2-yl]methyl]propan-2-amine
PubChem CID62419615
Molecular FormulaC18H30N2O
Molecular Weight290.45 g/mol
Exact Mass290.24
IUPAC NameN-[[5-[[methyl-[(4-methylphenyl)methyl]amino]methyl]oxolan-2-yl]methyl]propan-2-amine
SMILESCc1ccc(CN(C)CC2CCC(CNC(C)C)O2)cc1
InChIInChI=1S/C18H30N2O/c1-14(2)19-11-17-9-10-18(21-17)13-20(4)12-16-7-5-15(3)6-8-16/h5-8,14,17-19H,9-13H2,1-4H3
InChIKeyFVELHRYXUHWXCT-UHFFFAOYSA-N
XLogP2.97
TPSA24.50 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500290.45
LogP ≤ 52.97
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze N-[[5-[[methyl-[(4-methylphenyl)methyl]amino]methyl]oxolan-2-yl]methyl]propan-2-amine with MolForge

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Related Compounds

N-[[5-[[methyl(thiophen-2-ylmethyl)amino]methyl]oxolan-2-yl]methyl]propan-2-amine
CID 62420415
N-[[5-[[ethyl(methyl)amino]methyl]oxolan-2-yl]methyl]propan-2-amine
CID 62419141
N-methyl-N-[[5-[(propan-2-ylamino)methyl]oxolan-2-yl]methyl]aniline
CID 55070066
N-[[5-[[methyl(oxolan-2-ylmethyl)amino]methyl]oxolan-2-yl]methyl]propan-2-amine
CID 62437130
N,2-dimethyl-N-[[5-[(propan-2-ylamino)methyl]oxolan-2-yl]methyl]prop-2-en-1-amine
CID 113498784
N-cyclohexyl-N'-methyl-N'-[(4-methylphenyl)methyl]ethane-1,2-diamine
CID 62573288
2-methoxy-N-methyl-N-[[5-[(propan-2-ylamino)methyl]oxolan-2-yl]methyl]aniline
CID 62430750
N,2-dimethyl-N-[[5-[(propan-2-ylamino)methyl]oxolan-2-yl]methyl]butan-2-amine
CID 63965449
N-methyl-1-[5-[[methyl-[(5-methylfuran-2-yl)methyl]amino]methyl]oxolan-2-yl]methanamine
CID 62422461
[5-[[(4-methoxyphenyl)methyl-methylamino]methyl]oxolan-2-yl]methanamine
CID 62436799
1-[5-[[(3-bromophenyl)methyl-methylamino]methyl]oxolan-2-yl]-N-methylmethanamine
CID 62462715
N-methyl-2-[[methyl-[(4-methylphenyl)methyl]amino]methyl]cyclopentan-1-amine
CID 55093693

Frequently Asked Questions

What is the IUPAC name of N-[[5-[[methyl-[(4-methylphenyl)methyl]amino]methyl]oxolan-2-yl]methyl]propan-2-amine?
The IUPAC name of N-[[5-[[methyl-[(4-methylphenyl)methyl]amino]methyl]oxolan-2-yl]methyl]propan-2-amine (CID 62419615) is N-[[5-[[methyl-[(4-methylphenyl)methyl]amino]methyl]oxolan-2-yl]methyl]propan-2-amine.
What is the SMILES notation for N-[[5-[[methyl-[(4-methylphenyl)methyl]amino]methyl]oxolan-2-yl]methyl]propan-2-amine?
The canonical SMILES for N-[[5-[[methyl-[(4-methylphenyl)methyl]amino]methyl]oxolan-2-yl]methyl]propan-2-amine is Cc1ccc(CN(C)CC2CCC(CNC(C)C)O2)cc1.
What is the InChIKey of N-[[5-[[methyl-[(4-methylphenyl)methyl]amino]methyl]oxolan-2-yl]methyl]propan-2-amine?
The InChIKey is FVELHRYXUHWXCT-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H30N2O/c1-14(2)19-11-17-9-10-18(21-17)13-20(4)12-16-7-5-15(3)6-8-16/h5-8,14,17-19H,9-13H2,1-4H3.
What are the key properties of N-[[5-[[methyl-[(4-methylphenyl)methyl]amino]methyl]oxolan-2-yl]methyl]propan-2-amine?
N-[[5-[[methyl-[(4-methylphenyl)methyl]amino]methyl]oxolan-2-yl]methyl]propan-2-amine has a molecular weight of 290.45 g/mol, XLogP of 2.97, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[5-[[methyl-[(4-methylphenyl)methyl]amino]methyl]oxolan-2-yl]methyl]propan-2-amine is sourced from PubChem (CID 62419615), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).