N-[[5-(2,2-dimethylpyrrolidin-1-yl)pyrazin-2-yl]methyl]cyclopropanamine

C14H22N4 — CID 107380178

IUPACN-[[5-(2,2-dimethylpyrrolidin-1-yl)pyrazin-2-yl]methyl]cyclopropanamine
SMILESCC1(C)CCCN1c1cnc(CNC2CC2)cn1
InChIInChI=1S/C14H22N4/c1-14(2)6-3-7-18(14)13-10-16-12(9-17-13)8-15-11-4-5-11/h9-11,15H,3-8H2,1-2H3
InChIKeyIJEYCTVCJMDHDN-UHFFFAOYSA-N
MW246.36 g/mol
LogP2.11
Rot. Bonds4

About N-[[5-(2,2-dimethylpyrrolidin-1-yl)pyrazin-2-yl]methyl]cyclopropanamine

N-[[5-(2,2-dimethylpyrrolidin-1-yl)pyrazin-2-yl]methyl]cyclopropanamine (PubChem CID 107380178) has the molecular formula C14H22N4 and a molecular weight of 246.36 g/mol. Its IUPAC name is N-[[5-(2,2-dimethylpyrrolidin-1-yl)pyrazin-2-yl]methyl]cyclopropanamine.

Molecular Properties

Compound NameN-[[5-(2,2-dimethylpyrrolidin-1-yl)pyrazin-2-yl]methyl]cyclopropanamine
PubChem CID107380178
Molecular FormulaC14H22N4
Molecular Weight246.36 g/mol
Exact Mass246.18
IUPAC NameN-[[5-(2,2-dimethylpyrrolidin-1-yl)pyrazin-2-yl]methyl]cyclopropanamine
SMILESCC1(C)CCCN1c1cnc(CNC2CC2)cn1
InChIInChI=1S/C14H22N4/c1-14(2)6-3-7-18(14)13-10-16-12(9-17-13)8-15-11-4-5-11/h9-11,15H,3-8H2,1-2H3
InChIKeyIJEYCTVCJMDHDN-UHFFFAOYSA-N
XLogP2.11
TPSA41.05 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500246.36
LogP ≤ 52.11
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-[[5-(2,2-dimethylmorpholin-4-yl)pyrazin-2-yl]methyl]cyclopropanamine
CID 107379282
N-[[5-(4-propan-2-ylpiperazin-1-yl)pyrazin-2-yl]methyl]cyclopropanamine
CID 107379247
N-[[5-[(4aR,8aR)-3,4,4a,5,6,7,8,8a-octahydro-2H-quinolin-1-yl]pyrazin-2-yl]methyl]cyclopropanamine
CID 107381002
N-[[5-(2-ethylmorpholin-4-yl)pyrazin-2-yl]methyl]cyclopropanamine
CID 107379195
N-[[5-chloro-2-(2,2-dimethylpyrrolidin-1-yl)phenyl]methyl]cyclopropanamine
CID 114851124
N-[[5-(4-iodopyrazol-1-yl)pyrazin-2-yl]methyl]cyclopropanamine
CID 107381237
5-[(cyclobutylamino)methyl]pyrazine-2-carboxylic acid
CID 117213219
N-[[5-(3-propan-2-ylpyrazol-1-yl)pyrazin-2-yl]methyl]cyclopropanamine
CID 107381217
N-[[5-(4,4-dimethylazepan-1-yl)pyrazin-2-yl]methyl]propan-2-amine
CID 107380419
N-[(5-methyl-2-pyridinyl)methyl]cyclopropanamine
CID 80708604
4-tert-butyl-N-[(5-methylpyrazin-2-yl)methyl]cyclohexan-1-amine
CID 62845689
N-[[4-[(2,2-dimethylpyrrolidin-1-yl)methyl]-1,3-thiazol-2-yl]methyl]cyclopropanamine
CID 63218474

Frequently Asked Questions

What is the IUPAC name of N-[[5-(2,2-dimethylpyrrolidin-1-yl)pyrazin-2-yl]methyl]cyclopropanamine?
The IUPAC name of N-[[5-(2,2-dimethylpyrrolidin-1-yl)pyrazin-2-yl]methyl]cyclopropanamine (CID 107380178) is N-[[5-(2,2-dimethylpyrrolidin-1-yl)pyrazin-2-yl]methyl]cyclopropanamine.
What is the SMILES notation for N-[[5-(2,2-dimethylpyrrolidin-1-yl)pyrazin-2-yl]methyl]cyclopropanamine?
The canonical SMILES for N-[[5-(2,2-dimethylpyrrolidin-1-yl)pyrazin-2-yl]methyl]cyclopropanamine is CC1(C)CCCN1c1cnc(CNC2CC2)cn1.
What is the InChIKey of N-[[5-(2,2-dimethylpyrrolidin-1-yl)pyrazin-2-yl]methyl]cyclopropanamine?
The InChIKey is IJEYCTVCJMDHDN-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H22N4/c1-14(2)6-3-7-18(14)13-10-16-12(9-17-13)8-15-11-4-5-11/h9-11,15H,3-8H2,1-2H3.
What are the key properties of N-[[5-(2,2-dimethylpyrrolidin-1-yl)pyrazin-2-yl]methyl]cyclopropanamine?
N-[[5-(2,2-dimethylpyrrolidin-1-yl)pyrazin-2-yl]methyl]cyclopropanamine has a molecular weight of 246.36 g/mol, XLogP of 2.11, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[5-(2,2-dimethylpyrrolidin-1-yl)pyrazin-2-yl]methyl]cyclopropanamine is sourced from PubChem (CID 107380178), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).