N-[[1-(2-methylpropyl)pyrrolidin-2-yl]methyl]propan-2-amine

C12H26N2 — CID 62579624

IUPACN-[[1-(2-methylpropyl)pyrrolidin-2-yl]methyl]propan-2-amine
SMILESCC(C)CN1CCCC1CNC(C)C
InChIInChI=1S/C12H26N2/c1-10(2)9-14-7-5-6-12(14)8-13-11(3)4/h10-13H,5-9H2,1-4H3
InChIKeyFLEQJKKBXFHRRF-UHFFFAOYSA-N
MW198.35 g/mol
LogP2.10
Rot. Bonds5

About N-[[1-(2-methylpropyl)pyrrolidin-2-yl]methyl]propan-2-amine

N-[[1-(2-methylpropyl)pyrrolidin-2-yl]methyl]propan-2-amine (PubChem CID 62579624) has the molecular formula C12H26N2 and a molecular weight of 198.35 g/mol. Its IUPAC name is N-[[1-(2-methylpropyl)pyrrolidin-2-yl]methyl]propan-2-amine.

Molecular Properties

Compound NameN-[[1-(2-methylpropyl)pyrrolidin-2-yl]methyl]propan-2-amine
PubChem CID62579624
Molecular FormulaC12H26N2
Molecular Weight198.35 g/mol
Exact Mass198.21
IUPAC NameN-[[1-(2-methylpropyl)pyrrolidin-2-yl]methyl]propan-2-amine
SMILESCC(C)CN1CCCC1CNC(C)C
InChIInChI=1S/C12H26N2/c1-10(2)9-14-7-5-6-12(14)8-13-11(3)4/h10-13H,5-9H2,1-4H3
InChIKeyFLEQJKKBXFHRRF-UHFFFAOYSA-N
XLogP2.10
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500198.35
LogP ≤ 52.10
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-[[(2S)-1-(2-methylpropyl)pyrrolidin-2-yl]methyl]pentan-3-amine
CID 103904920
2-methyl-N-[[(2S)-1-(2-methylpropyl)pyrrolidin-2-yl]methyl]propan-1-amine
CID 103880736
N-[[(2S)-1-(2-methylpropyl)pyrrolidin-2-yl]methyl]cyclopentanamine
CID 103852150
N-[(1-propylpyrrolidin-2-yl)methyl]propan-2-amine
CID 62579817
2,2-dimethyl-N-[[(2R)-1-(2-methylpropyl)pyrrolidin-2-yl]methyl]propan-1-amine
CID 103838761
(2R)-2-(fluoromethyl)-1-(2-methylpropyl)pyrrolidine
CID 165411366
2-methoxy-N-[[1-(2-methylpropyl)pyrrolidin-2-yl]methyl]ethanamine
CID 62581642
N-[[(2S)-1-(2-methylpropyl)pyrrolidin-2-yl]methyl]-1-(1-methylpyrazol-4-yl)ethanamine
CID 75441559
2-[1-(2-methylpropyl)pyrrolidin-2-yl]ethanol
CID 117028492
N-[[1-(2-ethoxyethyl)pyrrolidin-2-yl]methyl]propan-2-amine
CID 62581621
N-[(1-ethylpyrrolidin-2-yl)methyl]butan-2-amine
CID 43195916
N-[[1-(2-propoxyethyl)pyrrolidin-2-yl]methyl]propan-2-amine
CID 106453472

Frequently Asked Questions

What is the IUPAC name of N-[[1-(2-methylpropyl)pyrrolidin-2-yl]methyl]propan-2-amine?
The IUPAC name of N-[[1-(2-methylpropyl)pyrrolidin-2-yl]methyl]propan-2-amine (CID 62579624) is N-[[1-(2-methylpropyl)pyrrolidin-2-yl]methyl]propan-2-amine.
What is the SMILES notation for N-[[1-(2-methylpropyl)pyrrolidin-2-yl]methyl]propan-2-amine?
The canonical SMILES for N-[[1-(2-methylpropyl)pyrrolidin-2-yl]methyl]propan-2-amine is CC(C)CN1CCCC1CNC(C)C.
What is the InChIKey of N-[[1-(2-methylpropyl)pyrrolidin-2-yl]methyl]propan-2-amine?
The InChIKey is FLEQJKKBXFHRRF-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H26N2/c1-10(2)9-14-7-5-6-12(14)8-13-11(3)4/h10-13H,5-9H2,1-4H3.
What are the key properties of N-[[1-(2-methylpropyl)pyrrolidin-2-yl]methyl]propan-2-amine?
N-[[1-(2-methylpropyl)pyrrolidin-2-yl]methyl]propan-2-amine has a molecular weight of 198.35 g/mol, XLogP of 2.10, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[1-(2-methylpropyl)pyrrolidin-2-yl]methyl]propan-2-amine is sourced from PubChem (CID 62579624), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).