N,N-dimethyl-1-(3-propan-2-yl-4-propylphenyl)methanamine

C15H25N — CID 153362784

IUPACN,N-dimethyl-1-(3-propan-2-yl-4-propylphenyl)methanamine
SMILESCCCc1ccc(CN(C)C)cc1C(C)C
InChIInChI=1S/C15H25N/c1-6-7-14-9-8-13(11-16(4)5)10-15(14)12(2)3/h8-10,12H,6-7,11H2,1-5H3
InChIKeyVQRJBDFSRVMYOY-UHFFFAOYSA-N
MW219.37 g/mol
LogP3.82
Rot. Bonds5

About N,N-dimethyl-1-(3-propan-2-yl-4-propylphenyl)methanamine

N,N-dimethyl-1-(3-propan-2-yl-4-propylphenyl)methanamine (PubChem CID 153362784) has the molecular formula C15H25N and a molecular weight of 219.37 g/mol. Its IUPAC name is N,N-dimethyl-1-(3-propan-2-yl-4-propylphenyl)methanamine.

Molecular Properties

Compound NameN,N-dimethyl-1-(3-propan-2-yl-4-propylphenyl)methanamine
PubChem CID153362784
Molecular FormulaC15H25N
Molecular Weight219.37 g/mol
Exact Mass219.20
IUPAC NameN,N-dimethyl-1-(3-propan-2-yl-4-propylphenyl)methanamine
SMILESCCCc1ccc(CN(C)C)cc1C(C)C
InChIInChI=1S/C15H25N/c1-6-7-14-9-8-13(11-16(4)5)10-15(14)12(2)3/h8-10,12H,6-7,11H2,1-5H3
InChIKeyVQRJBDFSRVMYOY-UHFFFAOYSA-N
XLogP3.82
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500219.37
LogP ≤ 53.82
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

4-chloro-2-propan-2-yl-1-propylbenzene;methanethiol
CID 153337592
(3-propan-2-yl-4-propylphenyl) 2-methylprop-2-enoate
CID 150431295
N,N-dimethyl-1-(2-propylphenyl)methanamine
CID 12709346
1-(3,4-dimethyl-5-propan-2-ylphenyl)-N,N-dimethylmethanamine
CID 166055872
4-[(dimethylamino)methyl]-2-octylphenol
CID 70503511
1-(5-chloro-2-ethyl-4-propan-2-ylphenyl)-N,N-dimethylmethanamine
CID 168889914
4-[2-(4-amino-2-propan-2-ylphenyl)ethyl]-3-propan-2-ylaniline
CID 22019812
4-propan-2-yl-1,2-dipropylbenzene
CID 123478662
N,N-dimethyl-1-(4-propylnaphthalen-1-yl)methanamine;methane
CID 157123555
1-ethyl-2-methyl-5-propan-2-yl-4-propylbenzene
CID 123747776
2-(4-ethoxy-2-propan-2-ylphenyl)ethanamine
CID 82054124
4-fluoro-2-pentan-3-yl-1-propylbenzene
CID 170087040

Frequently Asked Questions

What is the IUPAC name of N,N-dimethyl-1-(3-propan-2-yl-4-propylphenyl)methanamine?
The IUPAC name of N,N-dimethyl-1-(3-propan-2-yl-4-propylphenyl)methanamine (CID 153362784) is N,N-dimethyl-1-(3-propan-2-yl-4-propylphenyl)methanamine.
What is the SMILES notation for N,N-dimethyl-1-(3-propan-2-yl-4-propylphenyl)methanamine?
The canonical SMILES for N,N-dimethyl-1-(3-propan-2-yl-4-propylphenyl)methanamine is CCCc1ccc(CN(C)C)cc1C(C)C.
What is the InChIKey of N,N-dimethyl-1-(3-propan-2-yl-4-propylphenyl)methanamine?
The InChIKey is VQRJBDFSRVMYOY-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H25N/c1-6-7-14-9-8-13(11-16(4)5)10-15(14)12(2)3/h8-10,12H,6-7,11H2,1-5H3.
What are the key properties of N,N-dimethyl-1-(3-propan-2-yl-4-propylphenyl)methanamine?
N,N-dimethyl-1-(3-propan-2-yl-4-propylphenyl)methanamine has a molecular weight of 219.37 g/mol, XLogP of 3.82, 5 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-dimethyl-1-(3-propan-2-yl-4-propylphenyl)methanamine is sourced from PubChem (CID 153362784), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).