cycloheptanamine;phenylmethanamine

C14H24N2 — CID 162192852

IUPACcycloheptanamine;phenylmethanamine
SMILESNC1CCCCCC1.NCc1ccccc1
InChIInChI=1S/C7H9N.C7H15N/c8-6-7-4-2-1-3-5-7;8-7-5-3-1-2-4-6-7/h1-5H,6,8H2;7H,1-6,8H2
InChIKeyZQNUPKBSYMVYJB-UHFFFAOYSA-N
MW220.36 g/mol
LogP2.81
Rot. Bonds1

About cycloheptanamine;phenylmethanamine

cycloheptanamine;phenylmethanamine (PubChem CID 162192852) has the molecular formula C14H24N2 and a molecular weight of 220.36 g/mol. Its IUPAC name is cycloheptanamine;phenylmethanamine.

Molecular Properties

Compound Namecycloheptanamine;phenylmethanamine
PubChem CID162192852
Molecular FormulaC14H24N2
Molecular Weight220.36 g/mol
Exact Mass220.19
IUPAC Namecycloheptanamine;phenylmethanamine
SMILESNC1CCCCCC1.NCc1ccccc1
InChIInChI=1S/C7H9N.C7H15N/c8-6-7-4-2-1-3-5-7;8-7-5-3-1-2-4-6-7/h1-5H,6,8H2;7H,1-6,8H2
InChIKeyZQNUPKBSYMVYJB-UHFFFAOYSA-N
XLogP2.81
TPSA52.04 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500220.36
LogP ≤ 52.81
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

cyclopentanamine;(4-fluorophenyl)methanamine
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phenylmethanamine
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phenylmethanamine;titanium(2+)
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sodium phenylmethanamine
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[1,3-bis(cyclohexylmethyl)imidazol-2-ylidene]platinum;phenylmethanamine
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cyclohexanamine;2-phenylmethoxyethanol
CID 143913686
CID 174688914
CID 174688914
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Frequently Asked Questions

What is the IUPAC name of cycloheptanamine;phenylmethanamine?
The IUPAC name of cycloheptanamine;phenylmethanamine (CID 162192852) is cycloheptanamine;phenylmethanamine.
What is the SMILES notation for cycloheptanamine;phenylmethanamine?
The canonical SMILES for cycloheptanamine;phenylmethanamine is NC1CCCCCC1.NCc1ccccc1.
What is the InChIKey of cycloheptanamine;phenylmethanamine?
The InChIKey is ZQNUPKBSYMVYJB-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H9N.C7H15N/c8-6-7-4-2-1-3-5-7;8-7-5-3-1-2-4-6-7/h1-5H,6,8H2;7H,1-6,8H2.
What are the key properties of cycloheptanamine;phenylmethanamine?
cycloheptanamine;phenylmethanamine has a molecular weight of 220.36 g/mol, XLogP of 2.81, 1 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for cycloheptanamine;phenylmethanamine is sourced from PubChem (CID 162192852), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).