N-(1-cyclopropylethyl)-2-pyrrolidin-1-ylpropan-1-amine

C12H24N2 — CID 79692352

IUPACN-(1-cyclopropylethyl)-2-pyrrolidin-1-ylpropan-1-amine
SMILESCC(NCC(C)N1CCCC1)C1CC1
InChIInChI=1S/C12H24N2/c1-10(14-7-3-4-8-14)9-13-11(2)12-5-6-12/h10-13H,3-9H2,1-2H3
InChIKeyRBSDEZWZYVFMCL-UHFFFAOYSA-N
MW196.34 g/mol
LogP1.86
Rot. Bonds5

About N-(1-cyclopropylethyl)-2-pyrrolidin-1-ylpropan-1-amine

N-(1-cyclopropylethyl)-2-pyrrolidin-1-ylpropan-1-amine (PubChem CID 79692352) has the molecular formula C12H24N2 and a molecular weight of 196.34 g/mol. Its IUPAC name is N-(1-cyclopropylethyl)-2-pyrrolidin-1-ylpropan-1-amine.

Molecular Properties

Compound NameN-(1-cyclopropylethyl)-2-pyrrolidin-1-ylpropan-1-amine
PubChem CID79692352
Molecular FormulaC12H24N2
Molecular Weight196.34 g/mol
Exact Mass196.19
IUPAC NameN-(1-cyclopropylethyl)-2-pyrrolidin-1-ylpropan-1-amine
SMILESCC(NCC(C)N1CCCC1)C1CC1
InChIInChI=1S/C12H24N2/c1-10(14-7-3-4-8-14)9-13-11(2)12-5-6-12/h10-13H,3-9H2,1-2H3
InChIKeyRBSDEZWZYVFMCL-UHFFFAOYSA-N
XLogP1.86
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500196.34
LogP ≤ 51.86
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-(1-cyclopentylethyl)-2-piperidin-1-ylpropan-1-amine
CID 62632654
N-[1-(1-methylpiperidin-3-yl)ethyl]-2-piperidin-1-ylpropan-1-amine
CID 54899364
N-propan-2-yl-2-(4-propan-2-ylpiperidin-1-yl)propan-1-amine
CID 103503231
methyl 2-cyclopropyl-2-(2-pyrrolidin-1-ylpropylamino)acetate
CID 103259490
N-(2-piperidin-1-ylpropyl)cyclopropanamine
CID 62424338
N-(1-ethylsulfonylpropan-2-yl)-2-piperidin-1-ylpropan-1-amine
CID 113350724
N-[2-(azocan-1-yl)propyl]cyclopentanamine
CID 62558696
(2S)-1-[[(1R)-1-cyclopropylethyl]amino]propan-2-ol
CID 93082136
N-[(1R)-1-cyclopentylethyl]-2-methylpropan-1-amine
CID 81394382
N-[2-(azocan-1-yl)ethyl]-1-cyclopropylethanamine
CID 62574708
1-[[(1R)-1-cyclopentylethyl]amino]-3-pyrrolidin-1-ylpropan-2-ol
CID 81396165
2-methyl-N-[1-(1-methylpiperidin-4-yl)ethyl]propan-1-amine
CID 43307393

Frequently Asked Questions

What is the IUPAC name of N-(1-cyclopropylethyl)-2-pyrrolidin-1-ylpropan-1-amine?
The IUPAC name of N-(1-cyclopropylethyl)-2-pyrrolidin-1-ylpropan-1-amine (CID 79692352) is N-(1-cyclopropylethyl)-2-pyrrolidin-1-ylpropan-1-amine.
What is the SMILES notation for N-(1-cyclopropylethyl)-2-pyrrolidin-1-ylpropan-1-amine?
The canonical SMILES for N-(1-cyclopropylethyl)-2-pyrrolidin-1-ylpropan-1-amine is CC(NCC(C)N1CCCC1)C1CC1.
What is the InChIKey of N-(1-cyclopropylethyl)-2-pyrrolidin-1-ylpropan-1-amine?
The InChIKey is RBSDEZWZYVFMCL-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H24N2/c1-10(14-7-3-4-8-14)9-13-11(2)12-5-6-12/h10-13H,3-9H2,1-2H3.
What are the key properties of N-(1-cyclopropylethyl)-2-pyrrolidin-1-ylpropan-1-amine?
N-(1-cyclopropylethyl)-2-pyrrolidin-1-ylpropan-1-amine has a molecular weight of 196.34 g/mol, XLogP of 1.86, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-cyclopropylethyl)-2-pyrrolidin-1-ylpropan-1-amine is sourced from PubChem (CID 79692352), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).