N-methylmethanamine;1-propyl-N-pyridin-4-ylcarbazol-9-amine

C22H26N4 — CID 19849772

IUPACN-methylmethanamine;1-propyl-N-pyridin-4-ylcarbazol-9-amine
SMILESCCCc1cccc2c3ccccc3n(Nc3ccncc3)c12.CNC
InChIInChI=1S/C20H19N3.C2H7N/c1-2-6-15-7-5-9-18-17-8-3-4-10-19(17)23(20(15)18)22-16-11-13-21-14-12-16;1-3-2/h3-5,7-14H,2,6H2,1H3,(H,21,22);3H,1-2H3
InChIKeyBTZKQGLATZAMSV-UHFFFAOYSA-N
MW346.48 g/mol
LogP4.85
Rot. Bonds4

About N-methylmethanamine;1-propyl-N-pyridin-4-ylcarbazol-9-amine

N-methylmethanamine;1-propyl-N-pyridin-4-ylcarbazol-9-amine (PubChem CID 19849772) has the molecular formula C22H26N4 and a molecular weight of 346.48 g/mol. Its IUPAC name is N-methylmethanamine;1-propyl-N-pyridin-4-ylcarbazol-9-amine.

Molecular Properties

Compound NameN-methylmethanamine;1-propyl-N-pyridin-4-ylcarbazol-9-amine
PubChem CID19849772
Molecular FormulaC22H26N4
Molecular Weight346.48 g/mol
Exact Mass346.22
IUPAC NameN-methylmethanamine;1-propyl-N-pyridin-4-ylcarbazol-9-amine
SMILESCCCc1cccc2c3ccccc3n(Nc3ccncc3)c12.CNC
InChIInChI=1S/C20H19N3.C2H7N/c1-2-6-15-7-5-9-18-17-8-3-4-10-19(17)23(20(15)18)22-16-11-13-21-14-12-16;1-3-2/h3-5,7-14H,2,6H2,1H3,(H,21,22);3H,1-2H3
InChIKeyBTZKQGLATZAMSV-UHFFFAOYSA-N
XLogP4.85
TPSA41.88 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500346.48
LogP ≤ 54.85
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-methylmethanamine;1-propyl-N-pyridin-4-ylcarbazol-9-amine?
The IUPAC name of N-methylmethanamine;1-propyl-N-pyridin-4-ylcarbazol-9-amine (CID 19849772) is N-methylmethanamine;1-propyl-N-pyridin-4-ylcarbazol-9-amine.
What is the SMILES notation for N-methylmethanamine;1-propyl-N-pyridin-4-ylcarbazol-9-amine?
The canonical SMILES for N-methylmethanamine;1-propyl-N-pyridin-4-ylcarbazol-9-amine is CCCc1cccc2c3ccccc3n(Nc3ccncc3)c12.CNC.
What is the InChIKey of N-methylmethanamine;1-propyl-N-pyridin-4-ylcarbazol-9-amine?
The InChIKey is BTZKQGLATZAMSV-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H19N3.C2H7N/c1-2-6-15-7-5-9-18-17-8-3-4-10-19(17)23(20(15)18)22-16-11-13-21-14-12-16;1-3-2/h3-5,7-14H,2,6H2,1H3,(H,21,22);3H,1-2H3.
What are the key properties of N-methylmethanamine;1-propyl-N-pyridin-4-ylcarbazol-9-amine?
N-methylmethanamine;1-propyl-N-pyridin-4-ylcarbazol-9-amine has a molecular weight of 346.48 g/mol, XLogP of 4.85, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-methylmethanamine;1-propyl-N-pyridin-4-ylcarbazol-9-amine is sourced from PubChem (CID 19849772), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).