(7-methoxy-2,3,4,9-tetrahydro-1H-carbazol-1-yl)methanamine

C14H18N2O — CID 84626254

IUPAC(7-methoxy-2,3,4,9-tetrahydro-1H-carbazol-1-yl)methanamine
SMILESCOc1ccc2c3c([nH]c2c1)C(CN)CCC3
InChIInChI=1S/C14H18N2O/c1-17-10-5-6-11-12-4-2-3-9(8-15)14(12)16-13(11)7-10/h5-7,9,16H,2-4,8,15H2,1H3
InChIKeyPCCBIPGWMNGGJT-UHFFFAOYSA-N
MW230.31 g/mol
LogP2.56
Rot. Bonds2

About (7-methoxy-2,3,4,9-tetrahydro-1H-carbazol-1-yl)methanamine

(7-methoxy-2,3,4,9-tetrahydro-1H-carbazol-1-yl)methanamine (PubChem CID 84626254) has the molecular formula C14H18N2O and a molecular weight of 230.31 g/mol. Its IUPAC name is (7-methoxy-2,3,4,9-tetrahydro-1H-carbazol-1-yl)methanamine.

Molecular Properties

Compound Name(7-methoxy-2,3,4,9-tetrahydro-1H-carbazol-1-yl)methanamine
PubChem CID84626254
Molecular FormulaC14H18N2O
Molecular Weight230.31 g/mol
Exact Mass230.14
IUPAC Name(7-methoxy-2,3,4,9-tetrahydro-1H-carbazol-1-yl)methanamine
SMILESCOc1ccc2c3c([nH]c2c1)C(CN)CCC3
InChIInChI=1S/C14H18N2O/c1-17-10-5-6-11-12-4-2-3-9(8-15)14(12)16-13(11)7-10/h5-7,9,16H,2-4,8,15H2,1H3
InChIKeyPCCBIPGWMNGGJT-UHFFFAOYSA-N
XLogP2.56
TPSA51.04 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500230.31
LogP ≤ 52.56
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of (7-methoxy-2,3,4,9-tetrahydro-1H-carbazol-1-yl)methanamine?
The IUPAC name of (7-methoxy-2,3,4,9-tetrahydro-1H-carbazol-1-yl)methanamine (CID 84626254) is (7-methoxy-2,3,4,9-tetrahydro-1H-carbazol-1-yl)methanamine.
What is the SMILES notation for (7-methoxy-2,3,4,9-tetrahydro-1H-carbazol-1-yl)methanamine?
The canonical SMILES for (7-methoxy-2,3,4,9-tetrahydro-1H-carbazol-1-yl)methanamine is COc1ccc2c3c([nH]c2c1)C(CN)CCC3.
What is the InChIKey of (7-methoxy-2,3,4,9-tetrahydro-1H-carbazol-1-yl)methanamine?
The InChIKey is PCCBIPGWMNGGJT-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H18N2O/c1-17-10-5-6-11-12-4-2-3-9(8-15)14(12)16-13(11)7-10/h5-7,9,16H,2-4,8,15H2,1H3.
What are the key properties of (7-methoxy-2,3,4,9-tetrahydro-1H-carbazol-1-yl)methanamine?
(7-methoxy-2,3,4,9-tetrahydro-1H-carbazol-1-yl)methanamine has a molecular weight of 230.31 g/mol, XLogP of 2.56, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (7-methoxy-2,3,4,9-tetrahydro-1H-carbazol-1-yl)methanamine is sourced from PubChem (CID 84626254), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).