N-methyl-5-[(2-methylpropylamino)methyl]-N-[(1-methylpyrrolidin-3-yl)methyl]pyrazin-2-amine

C16H29N5 — CID 107380202

IUPACN-methyl-5-[(2-methylpropylamino)methyl]-N-[(1-methylpyrrolidin-3-yl)methyl]pyrazin-2-amine
SMILESCC(C)CNCc1cnc(N(C)CC2CCN(C)C2)cn1
InChIInChI=1S/C16H29N5/c1-13(2)7-17-8-15-9-19-16(10-18-15)21(4)12-14-5-6-20(3)11-14/h9-10,13-14,17H,5-8,11-12H2,1-4H3
InChIKeyKNFSKPIFPDMYMV-UHFFFAOYSA-N
MW291.44 g/mol
LogP1.61
Rot. Bonds7

About N-methyl-5-[(2-methylpropylamino)methyl]-N-[(1-methylpyrrolidin-3-yl)methyl]pyrazin-2-amine

N-methyl-5-[(2-methylpropylamino)methyl]-N-[(1-methylpyrrolidin-3-yl)methyl]pyrazin-2-amine (PubChem CID 107380202) has the molecular formula C16H29N5 and a molecular weight of 291.44 g/mol. Its IUPAC name is N-methyl-5-[(2-methylpropylamino)methyl]-N-[(1-methylpyrrolidin-3-yl)methyl]pyrazin-2-amine.

Molecular Properties

Compound NameN-methyl-5-[(2-methylpropylamino)methyl]-N-[(1-methylpyrrolidin-3-yl)methyl]pyrazin-2-amine
PubChem CID107380202
Molecular FormulaC16H29N5
Molecular Weight291.44 g/mol
Exact Mass291.24
IUPAC NameN-methyl-5-[(2-methylpropylamino)methyl]-N-[(1-methylpyrrolidin-3-yl)methyl]pyrazin-2-amine
SMILESCC(C)CNCc1cnc(N(C)CC2CCN(C)C2)cn1
InChIInChI=1S/C16H29N5/c1-13(2)7-17-8-15-9-19-16(10-18-15)21(4)12-14-5-6-20(3)11-14/h9-10,13-14,17H,5-8,11-12H2,1-4H3
InChIKeyKNFSKPIFPDMYMV-UHFFFAOYSA-N
XLogP1.61
TPSA44.29 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500291.44
LogP ≤ 51.61
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

N-(cyclohexylmethyl)-N-methyl-5-[(2-methylpropylamino)methyl]pyrazin-2-amine
CID 107379872
N,N-dimethyl-5-[(2-methylpropylamino)methyl]pyrazin-2-amine
CID 107378992
5-(ethylaminomethyl)-N-methyl-N-[(1-methylpyrrolidin-3-yl)methyl]pyridin-2-amine
CID 63274318
N-(cyclobutylmethyl)-N-methyl-6-[(2-methylpropylamino)methyl]pyrazin-2-amine
CID 66450489
N-benzyl-N-methyl-5-[(2-methylpropylamino)methyl]pyrazin-2-amine
CID 107378891
2-N-methyl-2-N-[(1-methylpyrrolidin-3-yl)methyl]pyrazine-2,6-diamine
CID 80647121
2-methyl-N-[[5-(4-methyl-1,4-diazepan-1-yl)pyrazin-2-yl]methyl]propan-1-amine
CID 107379011
N-[[5-[4-(methoxymethyl)piperidin-1-yl]pyrazin-2-yl]methyl]-2-methylpropan-1-amine
CID 107380346
2-methyl-N-[[3-[[methyl-[(1-methylpyrrolidin-3-yl)methyl]amino]methyl]furan-2-yl]methyl]propan-1-amine
CID 63274846
N-cyclopropyl-5-[(2-methylpropylamino)methyl]-N-(2,2,2-trifluoroethyl)pyrazin-2-amine
CID 107379370
N-methyl-6-[(2-methylpropylamino)methyl]-N-[(1-methylpyrrolidin-2-yl)methyl]pyridazin-3-amine
CID 79310788
4-N-methyl-4-N-[(1-methylpyrrolidin-3-yl)methyl]pyrimidine-4,6-diamine
CID 80829312

Frequently Asked Questions

What is the IUPAC name of N-methyl-5-[(2-methylpropylamino)methyl]-N-[(1-methylpyrrolidin-3-yl)methyl]pyrazin-2-amine?
The IUPAC name of N-methyl-5-[(2-methylpropylamino)methyl]-N-[(1-methylpyrrolidin-3-yl)methyl]pyrazin-2-amine (CID 107380202) is N-methyl-5-[(2-methylpropylamino)methyl]-N-[(1-methylpyrrolidin-3-yl)methyl]pyrazin-2-amine.
What is the SMILES notation for N-methyl-5-[(2-methylpropylamino)methyl]-N-[(1-methylpyrrolidin-3-yl)methyl]pyrazin-2-amine?
The canonical SMILES for N-methyl-5-[(2-methylpropylamino)methyl]-N-[(1-methylpyrrolidin-3-yl)methyl]pyrazin-2-amine is CC(C)CNCc1cnc(N(C)CC2CCN(C)C2)cn1.
What is the InChIKey of N-methyl-5-[(2-methylpropylamino)methyl]-N-[(1-methylpyrrolidin-3-yl)methyl]pyrazin-2-amine?
The InChIKey is KNFSKPIFPDMYMV-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H29N5/c1-13(2)7-17-8-15-9-19-16(10-18-15)21(4)12-14-5-6-20(3)11-14/h9-10,13-14,17H,5-8,11-12H2,1-4H3.
What are the key properties of N-methyl-5-[(2-methylpropylamino)methyl]-N-[(1-methylpyrrolidin-3-yl)methyl]pyrazin-2-amine?
N-methyl-5-[(2-methylpropylamino)methyl]-N-[(1-methylpyrrolidin-3-yl)methyl]pyrazin-2-amine has a molecular weight of 291.44 g/mol, XLogP of 1.61, 7 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-5-[(2-methylpropylamino)methyl]-N-[(1-methylpyrrolidin-3-yl)methyl]pyrazin-2-amine is sourced from PubChem (CID 107380202), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).