2-methyl-N-[(1-propylpyrrol-3-yl)methyl]cyclopropan-1-amine

C12H20N2 — CID 66414407

IUPAC2-methyl-N-[(1-propylpyrrol-3-yl)methyl]cyclopropan-1-amine
SMILESCCCn1ccc(CNC2CC2C)c1
InChIInChI=1S/C12H20N2/c1-3-5-14-6-4-11(9-14)8-13-12-7-10(12)2/h4,6,9-10,12-13H,3,5,7-8H2,1-2H3
InChIKeyQUSLDPALFLRWBU-UHFFFAOYSA-N
MW192.31 g/mol
LogP2.40
Rot. Bonds5

About 2-methyl-N-[(1-propylpyrrol-3-yl)methyl]cyclopropan-1-amine

2-methyl-N-[(1-propylpyrrol-3-yl)methyl]cyclopropan-1-amine (PubChem CID 66414407) has the molecular formula C12H20N2 and a molecular weight of 192.31 g/mol. Its IUPAC name is 2-methyl-N-[(1-propylpyrrol-3-yl)methyl]cyclopropan-1-amine.

Molecular Properties

Compound Name2-methyl-N-[(1-propylpyrrol-3-yl)methyl]cyclopropan-1-amine
PubChem CID66414407
Molecular FormulaC12H20N2
Molecular Weight192.31 g/mol
Exact Mass192.16
IUPAC Name2-methyl-N-[(1-propylpyrrol-3-yl)methyl]cyclopropan-1-amine
SMILESCCCn1ccc(CNC2CC2C)c1
InChIInChI=1S/C12H20N2/c1-3-5-14-6-4-11(9-14)8-13-12-7-10(12)2/h4,6,9-10,12-13H,3,5,7-8H2,1-2H3
InChIKeyQUSLDPALFLRWBU-UHFFFAOYSA-N
XLogP2.40
TPSA16.96 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500192.31
LogP ≤ 52.40
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-ethyl-N-[(1-propylpyrrol-3-yl)methyl]cyclopropan-1-amine
CID 103527273
N-[(1-ethylpyrrol-3-yl)methyl]-2,4-dimethylcyclohexan-1-amine
CID 66414811
4-ethyl-N-[(1-propylpyrrol-3-yl)methyl]cyclohexan-1-amine
CID 66416546
N-[(1-propylpyrrol-3-yl)methyl]-2,3-dihydro-1H-inden-2-amine
CID 103527697
1-propyl-N-[(1-propylpyrrol-3-yl)methyl]piperidin-4-amine
CID 66397545
N-[(1-ethylpyrrol-3-yl)methyl]-2-propylcyclopropan-1-amine
CID 103270528
N-[(2-methylpropan-2-yl)oxy]-1-(1-propylpyrrol-3-yl)methanamine
CID 82720010
1,1-dioxo-N-[(1-propylpyrrol-3-yl)methyl]thian-3-amine
CID 66414415
1-cyclohexyl-N-[(1-propylpyrrol-3-yl)methyl]methanamine
CID 66397562
N-[(1-ethylpyrrol-3-yl)methyl]-7-oxabicyclo[2.2.1]heptan-2-amine
CID 80714455
2-methyl-N-[(1-propylpyrrol-3-yl)methyl]butan-1-amine
CID 66416750
1-methyl-N-[(1-propylpyrrol-3-yl)methyl]pyrazol-4-amine
CID 66398631

Frequently Asked Questions

What is the IUPAC name of 2-methyl-N-[(1-propylpyrrol-3-yl)methyl]cyclopropan-1-amine?
The IUPAC name of 2-methyl-N-[(1-propylpyrrol-3-yl)methyl]cyclopropan-1-amine (CID 66414407) is 2-methyl-N-[(1-propylpyrrol-3-yl)methyl]cyclopropan-1-amine.
What is the SMILES notation for 2-methyl-N-[(1-propylpyrrol-3-yl)methyl]cyclopropan-1-amine?
The canonical SMILES for 2-methyl-N-[(1-propylpyrrol-3-yl)methyl]cyclopropan-1-amine is CCCn1ccc(CNC2CC2C)c1.
What is the InChIKey of 2-methyl-N-[(1-propylpyrrol-3-yl)methyl]cyclopropan-1-amine?
The InChIKey is QUSLDPALFLRWBU-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H20N2/c1-3-5-14-6-4-11(9-14)8-13-12-7-10(12)2/h4,6,9-10,12-13H,3,5,7-8H2,1-2H3.
What are the key properties of 2-methyl-N-[(1-propylpyrrol-3-yl)methyl]cyclopropan-1-amine?
2-methyl-N-[(1-propylpyrrol-3-yl)methyl]cyclopropan-1-amine has a molecular weight of 192.31 g/mol, XLogP of 2.40, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-N-[(1-propylpyrrol-3-yl)methyl]cyclopropan-1-amine is sourced from PubChem (CID 66414407), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).