N,N,1,3-tetramethyl-4-[[(1-methyl-3,4-dihydro-2H-quinolin-4-yl)methylamino]methyl]pyrazol-5-amine

C19H29N5 — CID 51105200

IUPACN,N,1,3-tetramethyl-4-[[(1-methyl-3,4-dihydro-2H-quinolin-4-yl)methylamino]methyl]pyrazol-5-amine
SMILESCc1nn(C)c(N(C)C)c1CNCC1CCN(C)c2ccccc21
InChIInChI=1S/C19H29N5/c1-14-17(19(22(2)3)24(5)21-14)13-20-12-15-10-11-23(4)18-9-7-6-8-16(15)18/h6-9,15,20H,10-13H2,1-5H3
InChIKeyQKHWLRGXDBLOSG-UHFFFAOYSA-N
MW327.48 g/mol
LogP2.51
Rot. Bonds5

About N,N,1,3-tetramethyl-4-[[(1-methyl-3,4-dihydro-2H-quinolin-4-yl)methylamino]methyl]pyrazol-5-amine

N,N,1,3-tetramethyl-4-[[(1-methyl-3,4-dihydro-2H-quinolin-4-yl)methylamino]methyl]pyrazol-5-amine (PubChem CID 51105200) has the molecular formula C19H29N5 and a molecular weight of 327.48 g/mol. Its IUPAC name is N,N,1,3-tetramethyl-4-[[(1-methyl-3,4-dihydro-2H-quinolin-4-yl)methylamino]methyl]pyrazol-5-amine.

Molecular Properties

Compound NameN,N,1,3-tetramethyl-4-[[(1-methyl-3,4-dihydro-2H-quinolin-4-yl)methylamino]methyl]pyrazol-5-amine
PubChem CID51105200
Molecular FormulaC19H29N5
Molecular Weight327.48 g/mol
Exact Mass327.24
IUPAC NameN,N,1,3-tetramethyl-4-[[(1-methyl-3,4-dihydro-2H-quinolin-4-yl)methylamino]methyl]pyrazol-5-amine
SMILESCc1nn(C)c(N(C)C)c1CNCC1CCN(C)c2ccccc21
InChIInChI=1S/C19H29N5/c1-14-17(19(22(2)3)24(5)21-14)13-20-12-15-10-11-23(4)18-9-7-6-8-16(15)18/h6-9,15,20H,10-13H2,1-5H3
InChIKeyQKHWLRGXDBLOSG-UHFFFAOYSA-N
XLogP2.51
TPSA36.33 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500327.48
LogP ≤ 52.51
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N,N,1,3-tetramethyl-4-[[(1-methyl-3,4-dihydro-2H-quinolin-4-yl)methylamino]methyl]pyrazol-5-amine?
The IUPAC name of N,N,1,3-tetramethyl-4-[[(1-methyl-3,4-dihydro-2H-quinolin-4-yl)methylamino]methyl]pyrazol-5-amine (CID 51105200) is N,N,1,3-tetramethyl-4-[[(1-methyl-3,4-dihydro-2H-quinolin-4-yl)methylamino]methyl]pyrazol-5-amine.
What is the SMILES notation for N,N,1,3-tetramethyl-4-[[(1-methyl-3,4-dihydro-2H-quinolin-4-yl)methylamino]methyl]pyrazol-5-amine?
The canonical SMILES for N,N,1,3-tetramethyl-4-[[(1-methyl-3,4-dihydro-2H-quinolin-4-yl)methylamino]methyl]pyrazol-5-amine is Cc1nn(C)c(N(C)C)c1CNCC1CCN(C)c2ccccc21.
What is the InChIKey of N,N,1,3-tetramethyl-4-[[(1-methyl-3,4-dihydro-2H-quinolin-4-yl)methylamino]methyl]pyrazol-5-amine?
The InChIKey is QKHWLRGXDBLOSG-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H29N5/c1-14-17(19(22(2)3)24(5)21-14)13-20-12-15-10-11-23(4)18-9-7-6-8-16(15)18/h6-9,15,20H,10-13H2,1-5H3.
What are the key properties of N,N,1,3-tetramethyl-4-[[(1-methyl-3,4-dihydro-2H-quinolin-4-yl)methylamino]methyl]pyrazol-5-amine?
N,N,1,3-tetramethyl-4-[[(1-methyl-3,4-dihydro-2H-quinolin-4-yl)methylamino]methyl]pyrazol-5-amine has a molecular weight of 327.48 g/mol, XLogP of 2.51, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N,N,1,3-tetramethyl-4-[[(1-methyl-3,4-dihydro-2H-quinolin-4-yl)methylamino]methyl]pyrazol-5-amine is sourced from PubChem (CID 51105200), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).