1-(1-methylpyrrolidin-3-yl)propan-2-amine

C8H18N2 — CID 71433430

IUPAC1-(1-methylpyrrolidin-3-yl)propan-2-amine
SMILESCC(N)CC1CCN(C)C1
InChIInChI=1S/C8H18N2/c1-7(9)5-8-3-4-10(2)6-8/h7-8H,3-6,9H2,1-2H3
InChIKeySXKGFWQEIZERLW-UHFFFAOYSA-N
MW142.25 g/mol
LogP0.68
Rot. Bonds2

About 1-(1-methylpyrrolidin-3-yl)propan-2-amine

1-(1-methylpyrrolidin-3-yl)propan-2-amine (PubChem CID 71433430) has the molecular formula C8H18N2 and a molecular weight of 142.25 g/mol. Its IUPAC name is 1-(1-methylpyrrolidin-3-yl)propan-2-amine.

Molecular Properties

Compound Name1-(1-methylpyrrolidin-3-yl)propan-2-amine
PubChem CID71433430
Molecular FormulaC8H18N2
Molecular Weight142.25 g/mol
Exact Mass142.15
IUPAC Name1-(1-methylpyrrolidin-3-yl)propan-2-amine
SMILESCC(N)CC1CCN(C)C1
InChIInChI=1S/C8H18N2/c1-7(9)5-8-3-4-10(2)6-8/h7-8H,3-6,9H2,1-2H3
InChIKeySXKGFWQEIZERLW-UHFFFAOYSA-N
XLogP0.68
TPSA29.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500142.25
LogP ≤ 50.68
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

5-(1-methylpyrrolidin-3-yl)pentan-2-amine
CID 116925099
methyl 2-methyl-3-(1-methylpyrrolidin-3-yl)propanoate
CID 83980575
3-methyl-2-[(1-methylpyrrolidin-3-yl)methyl]butanenitrile
CID 116931781
3-methyl-1-(1-methylpiperidin-3-yl)butan-2-amine
CID 83983005
1-methyl-3-(2,4,4-trimethylpentyl)pyrrolidine
CID 58283754
2-amino-N,N-dimethyl-3-(1-methylpyrrolidin-3-yl)propanamide
CID 116850275
1-methyl-3-(3-methylbutyl)pyrrolidine
CID 58945066
1-(1,4-dimethylpiperazin-2-yl)propan-2-amine
CID 115415048
1-(1-methylpyrrolidin-3-yl)pentan-3-amine
CID 83980580
3-methyl-4-(1-methylpiperidin-4-yl)butan-1-amine
CID 116924914
(2R)-1-cyclobutylpropan-2-amine
CID 124506916
3-(2-aminopropyl)pyrrolidine-1-carboximidamide
CID 21018796

Frequently Asked Questions

What is the IUPAC name of 1-(1-methylpyrrolidin-3-yl)propan-2-amine?
The IUPAC name of 1-(1-methylpyrrolidin-3-yl)propan-2-amine (CID 71433430) is 1-(1-methylpyrrolidin-3-yl)propan-2-amine.
What is the SMILES notation for 1-(1-methylpyrrolidin-3-yl)propan-2-amine?
The canonical SMILES for 1-(1-methylpyrrolidin-3-yl)propan-2-amine is CC(N)CC1CCN(C)C1.
What is the InChIKey of 1-(1-methylpyrrolidin-3-yl)propan-2-amine?
The InChIKey is SXKGFWQEIZERLW-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H18N2/c1-7(9)5-8-3-4-10(2)6-8/h7-8H,3-6,9H2,1-2H3.
What are the key properties of 1-(1-methylpyrrolidin-3-yl)propan-2-amine?
1-(1-methylpyrrolidin-3-yl)propan-2-amine has a molecular weight of 142.25 g/mol, XLogP of 0.68, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(1-methylpyrrolidin-3-yl)propan-2-amine is sourced from PubChem (CID 71433430), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).