N-ethyl-1-(2-methylpyrrolidin-1-yl)pentan-2-amine

C12H26N2 — CID 62042499

IUPACN-ethyl-1-(2-methylpyrrolidin-1-yl)pentan-2-amine
SMILESCCCC(CN1CCCC1C)NCC
InChIInChI=1S/C12H26N2/c1-4-7-12(13-5-2)10-14-9-6-8-11(14)3/h11-13H,4-10H2,1-3H3
InChIKeyKQZGSNIYXKVUJG-UHFFFAOYSA-N
MW198.35 g/mol
LogP2.25
Rot. Bonds6

About N-ethyl-1-(2-methylpyrrolidin-1-yl)pentan-2-amine

N-ethyl-1-(2-methylpyrrolidin-1-yl)pentan-2-amine (PubChem CID 62042499) has the molecular formula C12H26N2 and a molecular weight of 198.35 g/mol. Its IUPAC name is N-ethyl-1-(2-methylpyrrolidin-1-yl)pentan-2-amine.

Molecular Properties

Compound NameN-ethyl-1-(2-methylpyrrolidin-1-yl)pentan-2-amine
PubChem CID62042499
Molecular FormulaC12H26N2
Molecular Weight198.35 g/mol
Exact Mass198.21
IUPAC NameN-ethyl-1-(2-methylpyrrolidin-1-yl)pentan-2-amine
SMILESCCCC(CN1CCCC1C)NCC
InChIInChI=1S/C12H26N2/c1-4-7-12(13-5-2)10-14-9-6-8-11(14)3/h11-13H,4-10H2,1-3H3
InChIKeyKQZGSNIYXKVUJG-UHFFFAOYSA-N
XLogP2.25
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500198.35
LogP ≤ 52.25
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-ethyl-1-methoxy-3-(2-methylpiperidin-1-yl)propan-2-amine
CID 107505238
N-ethyl-1-(3-methylpiperidin-1-yl)pentan-2-amine
CID 62041614
4-(2-methylpiperidin-1-yl)-3-(propylamino)butan-1-ol
CID 64898364
N-ethyl-1-(3-methylpyrrolidin-1-yl)pentan-2-amine
CID 62044690
3-(methylamino)-4-(2-methylpyrrolidin-1-yl)butan-1-ol
CID 64898588
1-(3-methyl-3,4,6,7,8,8a-hexahydro-1H-pyrrolo[1,2-a]pyrazin-2-yl)-N-propylpentan-2-amine
CID 79938912
1-(3,4,6,7,8,8a-hexahydro-1H-pyrrolo[1,2-a]pyrazin-2-yl)-N-ethylpentan-2-amine
CID 79938837
(2R)-2-methyl-1-(2-methylheptyl)pyrrolidine
CID 126694482
2-(ethylamino)-4-(2-methylpyrrolidin-1-yl)butanenitrile
CID 63028079
1-[2-(bromomethyl)pentyl]-2-methylpiperidine
CID 65011001
2-(ethylamino)-1-(2-methylazocan-1-yl)pentan-3-one
CID 71154610
N-[2-(2-methylpyrrolidin-1-yl)-1-(4-propylphenyl)ethyl]propan-1-amine
CID 63468845

Frequently Asked Questions

What is the IUPAC name of N-ethyl-1-(2-methylpyrrolidin-1-yl)pentan-2-amine?
The IUPAC name of N-ethyl-1-(2-methylpyrrolidin-1-yl)pentan-2-amine (CID 62042499) is N-ethyl-1-(2-methylpyrrolidin-1-yl)pentan-2-amine.
What is the SMILES notation for N-ethyl-1-(2-methylpyrrolidin-1-yl)pentan-2-amine?
The canonical SMILES for N-ethyl-1-(2-methylpyrrolidin-1-yl)pentan-2-amine is CCCC(CN1CCCC1C)NCC.
What is the InChIKey of N-ethyl-1-(2-methylpyrrolidin-1-yl)pentan-2-amine?
The InChIKey is KQZGSNIYXKVUJG-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H26N2/c1-4-7-12(13-5-2)10-14-9-6-8-11(14)3/h11-13H,4-10H2,1-3H3.
What are the key properties of N-ethyl-1-(2-methylpyrrolidin-1-yl)pentan-2-amine?
N-ethyl-1-(2-methylpyrrolidin-1-yl)pentan-2-amine has a molecular weight of 198.35 g/mol, XLogP of 2.25, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-1-(2-methylpyrrolidin-1-yl)pentan-2-amine is sourced from PubChem (CID 62042499), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).