4-methyl-N-(1-pyrrolidin-1-ylpropan-2-yl)pentan-2-amine

C13H28N2 — CID 61471885

IUPAC4-methyl-N-(1-pyrrolidin-1-ylpropan-2-yl)pentan-2-amine
SMILESCC(C)CC(C)NC(C)CN1CCCC1
InChIInChI=1S/C13H28N2/c1-11(2)9-12(3)14-13(4)10-15-7-5-6-8-15/h11-14H,5-10H2,1-4H3
InChIKeyYMVFMEOZONMKOT-UHFFFAOYSA-N
MW212.38 g/mol
LogP2.49
Rot. Bonds6

About 4-methyl-N-(1-pyrrolidin-1-ylpropan-2-yl)pentan-2-amine

4-methyl-N-(1-pyrrolidin-1-ylpropan-2-yl)pentan-2-amine (PubChem CID 61471885) has the molecular formula C13H28N2 and a molecular weight of 212.38 g/mol. Its IUPAC name is 4-methyl-N-(1-pyrrolidin-1-ylpropan-2-yl)pentan-2-amine.

Molecular Properties

Compound Name4-methyl-N-(1-pyrrolidin-1-ylpropan-2-yl)pentan-2-amine
PubChem CID61471885
Molecular FormulaC13H28N2
Molecular Weight212.38 g/mol
Exact Mass212.23
IUPAC Name4-methyl-N-(1-pyrrolidin-1-ylpropan-2-yl)pentan-2-amine
SMILESCC(C)CC(C)NC(C)CN1CCCC1
InChIInChI=1S/C13H28N2/c1-11(2)9-12(3)14-13(4)10-15-7-5-6-8-15/h11-14H,5-10H2,1-4H3
InChIKeyYMVFMEOZONMKOT-UHFFFAOYSA-N
XLogP2.49
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500212.38
LogP ≤ 52.49
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

5-methyl-N-(1-piperidin-1-ylpropan-2-yl)hexan-2-amine
CID 43749079
3-(1-pyrrolidin-1-ylpropan-2-ylamino)butanenitrile
CID 61473651
(2S)-N-phosphanyl-1-pyrrolidin-1-ylpropan-2-amine
CID 143859597
N-(1-pyrrolidin-1-ylpropan-2-yl)but-3-en-2-amine
CID 107906758
1-(2-methylpropyl)piperidine;1-(2-methylpropyl)pyrrolidine
CID 159983719
azane;1-(2-methylpropyl)pyrrolidine
CID 122583370
3-methoxy-N-(1-pyrrolidin-1-ylpropan-2-yl)butan-2-amine
CID 115919081
3-methyl-N-(1-piperidin-1-ylpropan-2-yl)butan-1-amine
CID 43434983
2,6-dimethyl-N-(1-morpholin-4-ylpropan-2-yl)heptan-4-amine
CID 43675652
(2S)-4-methyl-2-(1-pyrrolidin-1-ylpropan-2-ylcarbamoylamino)pentanoic acid
CID 61475849
4-[3-(1-pyrrolidin-1-ylpropan-2-ylamino)butyl]phenol
CID 61471809
N-[1-(1-methylpiperidin-4-yl)ethyl]-1-pyrrolidin-1-ylpropan-2-amine
CID 54952865

Frequently Asked Questions

What is the IUPAC name of 4-methyl-N-(1-pyrrolidin-1-ylpropan-2-yl)pentan-2-amine?
The IUPAC name of 4-methyl-N-(1-pyrrolidin-1-ylpropan-2-yl)pentan-2-amine (CID 61471885) is 4-methyl-N-(1-pyrrolidin-1-ylpropan-2-yl)pentan-2-amine.
What is the SMILES notation for 4-methyl-N-(1-pyrrolidin-1-ylpropan-2-yl)pentan-2-amine?
The canonical SMILES for 4-methyl-N-(1-pyrrolidin-1-ylpropan-2-yl)pentan-2-amine is CC(C)CC(C)NC(C)CN1CCCC1.
What is the InChIKey of 4-methyl-N-(1-pyrrolidin-1-ylpropan-2-yl)pentan-2-amine?
The InChIKey is YMVFMEOZONMKOT-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H28N2/c1-11(2)9-12(3)14-13(4)10-15-7-5-6-8-15/h11-14H,5-10H2,1-4H3.
What are the key properties of 4-methyl-N-(1-pyrrolidin-1-ylpropan-2-yl)pentan-2-amine?
4-methyl-N-(1-pyrrolidin-1-ylpropan-2-yl)pentan-2-amine has a molecular weight of 212.38 g/mol, XLogP of 2.49, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methyl-N-(1-pyrrolidin-1-ylpropan-2-yl)pentan-2-amine is sourced from PubChem (CID 61471885), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).