N-methyl-N-(2-methylpyrrol-1-yl)pyridin-4-amine

C11H13N3 — CID 19774579

IUPACN-methyl-N-(2-methylpyrrol-1-yl)pyridin-4-amine
SMILESCc1cccn1N(C)c1ccncc1
InChIInChI=1S/C11H13N3/c1-10-4-3-9-14(10)13(2)11-5-7-12-8-6-11/h3-9H,1-2H3
InChIKeySZHFYVLLCPUXPR-UHFFFAOYSA-N
MW187.25 g/mol
LogP2.09
Rot. Bonds2

About N-methyl-N-(2-methylpyrrol-1-yl)pyridin-4-amine

N-methyl-N-(2-methylpyrrol-1-yl)pyridin-4-amine (PubChem CID 19774579) has the molecular formula C11H13N3 and a molecular weight of 187.25 g/mol. Its IUPAC name is N-methyl-N-(2-methylpyrrol-1-yl)pyridin-4-amine.

Molecular Properties

Compound NameN-methyl-N-(2-methylpyrrol-1-yl)pyridin-4-amine
PubChem CID19774579
Molecular FormulaC11H13N3
Molecular Weight187.25 g/mol
Exact Mass187.11
IUPAC NameN-methyl-N-(2-methylpyrrol-1-yl)pyridin-4-amine
SMILESCc1cccn1N(C)c1ccncc1
InChIInChI=1S/C11H13N3/c1-10-4-3-9-14(10)13(2)11-5-7-12-8-6-11/h3-9H,1-2H3
InChIKeySZHFYVLLCPUXPR-UHFFFAOYSA-N
XLogP2.09
TPSA21.06 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500187.25
LogP ≤ 52.09
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-methyl-N-(2-methylpyrrol-1-yl)pyridin-4-amine?
The IUPAC name of N-methyl-N-(2-methylpyrrol-1-yl)pyridin-4-amine (CID 19774579) is N-methyl-N-(2-methylpyrrol-1-yl)pyridin-4-amine.
What is the SMILES notation for N-methyl-N-(2-methylpyrrol-1-yl)pyridin-4-amine?
The canonical SMILES for N-methyl-N-(2-methylpyrrol-1-yl)pyridin-4-amine is Cc1cccn1N(C)c1ccncc1.
What is the InChIKey of N-methyl-N-(2-methylpyrrol-1-yl)pyridin-4-amine?
The InChIKey is SZHFYVLLCPUXPR-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H13N3/c1-10-4-3-9-14(10)13(2)11-5-7-12-8-6-11/h3-9H,1-2H3.
What are the key properties of N-methyl-N-(2-methylpyrrol-1-yl)pyridin-4-amine?
N-methyl-N-(2-methylpyrrol-1-yl)pyridin-4-amine has a molecular weight of 187.25 g/mol, XLogP of 2.09, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-N-(2-methylpyrrol-1-yl)pyridin-4-amine is sourced from PubChem (CID 19774579), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).