[2-(piperidin-1-ylmethyl)phenyl]methanamine

C13H20N2 — CID 6484223

IUPAC[2-(piperidin-1-ylmethyl)phenyl]methanamine
SMILESNCc1ccccc1CN1CCCCC1
InChIInChI=1S/C13H20N2/c14-10-12-6-2-3-7-13(12)11-15-8-4-1-5-9-15/h2-3,6-7H,1,4-5,8-11,14H2
InChIKeyLVWBHCPEDVLOCV-UHFFFAOYSA-N
MW204.32 g/mol
LogP2.13
Rot. Bonds3

About [2-(piperidin-1-ylmethyl)phenyl]methanamine

[2-(piperidin-1-ylmethyl)phenyl]methanamine (PubChem CID 6484223) has the molecular formula C13H20N2 and a molecular weight of 204.32 g/mol. Its IUPAC name is [2-(piperidin-1-ylmethyl)phenyl]methanamine.

Molecular Properties

Compound Name[2-(piperidin-1-ylmethyl)phenyl]methanamine
PubChem CID6484223
Molecular FormulaC13H20N2
Molecular Weight204.32 g/mol
Exact Mass204.16
IUPAC Name[2-(piperidin-1-ylmethyl)phenyl]methanamine
SMILESNCc1ccccc1CN1CCCCC1
InChIInChI=1S/C13H20N2/c14-10-12-6-2-3-7-13(12)11-15-8-4-1-5-9-15/h2-3,6-7H,1,4-5,8-11,14H2
InChIKeyLVWBHCPEDVLOCV-UHFFFAOYSA-N
XLogP2.13
TPSA29.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500204.32
LogP ≤ 52.13
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

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Azapetine
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N-Benzylphenethylamine
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1-Benzylpiperazine
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CID 9513
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CID 16622
Dibenzylamine
CID 7656
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CID 200601
2-Methyl-1,2,3,4-tetrahydroisoquinoline
CID 15362

Frequently Asked Questions

What is the IUPAC name of [2-(piperidin-1-ylmethyl)phenyl]methanamine?
The IUPAC name of [2-(piperidin-1-ylmethyl)phenyl]methanamine (CID 6484223) is [2-(piperidin-1-ylmethyl)phenyl]methanamine.
What is the SMILES notation for [2-(piperidin-1-ylmethyl)phenyl]methanamine?
The canonical SMILES for [2-(piperidin-1-ylmethyl)phenyl]methanamine is NCc1ccccc1CN1CCCCC1.
What is the InChIKey of [2-(piperidin-1-ylmethyl)phenyl]methanamine?
The InChIKey is LVWBHCPEDVLOCV-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H20N2/c14-10-12-6-2-3-7-13(12)11-15-8-4-1-5-9-15/h2-3,6-7H,1,4-5,8-11,14H2.
What are the key properties of [2-(piperidin-1-ylmethyl)phenyl]methanamine?
[2-(piperidin-1-ylmethyl)phenyl]methanamine has a molecular weight of 204.32 g/mol, XLogP of 2.13, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [2-(piperidin-1-ylmethyl)phenyl]methanamine is sourced from PubChem (CID 6484223), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).