N-methyl-1-phenyl-N-(piperidin-3-ylmethyl)propan-2-amine

C16H26N2 — CID 106623701

IUPACN-methyl-1-phenyl-N-(piperidin-3-ylmethyl)propan-2-amine
SMILESCC(Cc1ccccc1)N(C)CC1CCCNC1
InChIInChI=1S/C16H26N2/c1-14(11-15-7-4-3-5-8-15)18(2)13-16-9-6-10-17-12-16/h3-5,7-8,14,16-17H,6,9-13H2,1-2H3
InChIKeyWOAFAAFIGNREJX-UHFFFAOYSA-N
MW246.40 g/mol
LogP2.55
Rot. Bonds5

About N-methyl-1-phenyl-N-(piperidin-3-ylmethyl)propan-2-amine

N-methyl-1-phenyl-N-(piperidin-3-ylmethyl)propan-2-amine (PubChem CID 106623701) has the molecular formula C16H26N2 and a molecular weight of 246.40 g/mol. Its IUPAC name is N-methyl-1-phenyl-N-(piperidin-3-ylmethyl)propan-2-amine.

Molecular Properties

Compound NameN-methyl-1-phenyl-N-(piperidin-3-ylmethyl)propan-2-amine
PubChem CID106623701
Molecular FormulaC16H26N2
Molecular Weight246.40 g/mol
Exact Mass246.21
IUPAC NameN-methyl-1-phenyl-N-(piperidin-3-ylmethyl)propan-2-amine
SMILESCC(Cc1ccccc1)N(C)CC1CCCNC1
InChIInChI=1S/C16H26N2/c1-14(11-15-7-4-3-5-8-15)18(2)13-16-9-6-10-17-12-16/h3-5,7-8,14,16-17H,6,9-13H2,1-2H3
InChIKeyWOAFAAFIGNREJX-UHFFFAOYSA-N
XLogP2.55
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500246.40
LogP ≤ 52.55
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1-phenyl-N-(piperidin-3-ylmethyl)-N-propylpropan-2-amine
CID 106625214
N-methyl-1-(2-methylphenyl)-N-(piperidin-3-ylmethyl)propan-2-amine;hydrochloride
CID 120858044
2-[1-[methyl(piperidin-3-ylmethyl)amino]ethyl]phenol
CID 104870411
N-ethyl-4-phenyl-N-(piperidin-3-ylmethyl)butan-2-amine
CID 106624545
1-(2-chlorophenyl)-N-methyl-N-[[(3R)-piperidin-3-yl]methyl]ethanamine
CID 112736627
N-benzyl-N-[[(3S)-piperidin-3-yl]methyl]propan-1-amine
CID 129381793
N-methyl-2-phenyl-N-(piperidin-3-ylmethyl)propan-1-amine;hydrochloride
CID 119931376
N-methyl-N-(piperidin-3-ylmethyl)-1-pyridin-2-ylethanamine
CID 71637592
1-methoxy-N-methyl-N-(piperidin-3-ylmethyl)propan-2-amine
CID 61452791
1-(2-fluorophenyl)-N-methyl-N-(piperidin-3-ylmethyl)propan-1-amine
CID 106623894
N-methyl-1-phenyl-N-(pyrrolidin-3-ylmethyl)ethanamine
CID 23292007
1-(4-chlorophenyl)-N-methyl-N-(piperidin-4-ylmethyl)propan-2-amine
CID 103815876

Frequently Asked Questions

What is the IUPAC name of N-methyl-1-phenyl-N-(piperidin-3-ylmethyl)propan-2-amine?
The IUPAC name of N-methyl-1-phenyl-N-(piperidin-3-ylmethyl)propan-2-amine (CID 106623701) is N-methyl-1-phenyl-N-(piperidin-3-ylmethyl)propan-2-amine.
What is the SMILES notation for N-methyl-1-phenyl-N-(piperidin-3-ylmethyl)propan-2-amine?
The canonical SMILES for N-methyl-1-phenyl-N-(piperidin-3-ylmethyl)propan-2-amine is CC(Cc1ccccc1)N(C)CC1CCCNC1.
What is the InChIKey of N-methyl-1-phenyl-N-(piperidin-3-ylmethyl)propan-2-amine?
The InChIKey is WOAFAAFIGNREJX-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H26N2/c1-14(11-15-7-4-3-5-8-15)18(2)13-16-9-6-10-17-12-16/h3-5,7-8,14,16-17H,6,9-13H2,1-2H3.
What are the key properties of N-methyl-1-phenyl-N-(piperidin-3-ylmethyl)propan-2-amine?
N-methyl-1-phenyl-N-(piperidin-3-ylmethyl)propan-2-amine has a molecular weight of 246.40 g/mol, XLogP of 2.55, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-1-phenyl-N-(piperidin-3-ylmethyl)propan-2-amine is sourced from PubChem (CID 106623701), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).