N-methyl-1-[(2R,4R)-4-methylpyrrolidin-2-yl]methanamine

C7H16N2 — CID 147487511

IUPACN-methyl-1-[(2R,4R)-4-methylpyrrolidin-2-yl]methanamine
SMILESCNC[C@H]1C[C@@H](C)CN1
InChIInChI=1S/C7H16N2/c1-6-3-7(5-8-2)9-4-6/h6-9H,3-5H2,1-2H3/t6-,7-/m1/s1
InChIKeyFEWHVBXCYORMPQ-RNFRBKRXSA-N
MW128.22 g/mol
LogP0.20
Rot. Bonds2

About N-methyl-1-[(2R,4R)-4-methylpyrrolidin-2-yl]methanamine

N-methyl-1-[(2R,4R)-4-methylpyrrolidin-2-yl]methanamine (PubChem CID 147487511) has the molecular formula C7H16N2 and a molecular weight of 128.22 g/mol. Its IUPAC name is N-methyl-1-[(2R,4R)-4-methylpyrrolidin-2-yl]methanamine.

Molecular Properties

Compound NameN-methyl-1-[(2R,4R)-4-methylpyrrolidin-2-yl]methanamine
PubChem CID147487511
Molecular FormulaC7H16N2
Molecular Weight128.22 g/mol
Exact Mass128.13
IUPAC NameN-methyl-1-[(2R,4R)-4-methylpyrrolidin-2-yl]methanamine
SMILESCNC[C@H]1C[C@@H](C)CN1
InChIInChI=1S/C7H16N2/c1-6-3-7(5-8-2)9-4-6/h6-9H,3-5H2,1-2H3/t6-,7-/m1/s1
InChIKeyFEWHVBXCYORMPQ-RNFRBKRXSA-N
XLogP0.20
TPSA24.06 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500128.22
LogP ≤ 50.20
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

N-methyl-1-(5-methylpiperidin-2-yl)methanamine
CID 89022533
2-chloro-N-[[(2S)-4-methylpyrrolidin-2-yl]methyl]ethanamine
CID 131967910
(2S,4S)-4-methyl-2-[(sulfamoylamino)methyl]pyrrolidine
CID 122625851
2-(fluoromethyl)-4-methylpyrrolidine;hydrochloride
CID 138114248
[(4R)-4-methylpyrrolidin-2-yl]methanol
CID 149144026
[(2R,4S)-4-methylpyrrolidin-2-yl]methanol;hydrochloride
CID 68644094
ethane;4-methyl-2-propylpyrrolidine
CID 170743275
N-methyl-N'-[2-(4-methylpyrrolidin-2-yl)ethyl]-N'-propan-2-ylethane-1,2-diamine
CID 176601704
2-[(4S)-4-methylpyrrolidin-2-yl]acetonitrile
CID 170704101
N,N-dimethyl-1-(4-methylpyrrolidin-2-yl)methanamine;ethane
CID 168883366
(2S,4S)-2-hexyl-4-methylpyrrolidine
CID 101063075
N-ethyl-N-[2-(4-methylpyrrolidin-2-yl)ethyl]propan-2-amine
CID 176601984

Frequently Asked Questions

What is the IUPAC name of N-methyl-1-[(2R,4R)-4-methylpyrrolidin-2-yl]methanamine?
The IUPAC name of N-methyl-1-[(2R,4R)-4-methylpyrrolidin-2-yl]methanamine (CID 147487511) is N-methyl-1-[(2R,4R)-4-methylpyrrolidin-2-yl]methanamine.
What is the SMILES notation for N-methyl-1-[(2R,4R)-4-methylpyrrolidin-2-yl]methanamine?
The canonical SMILES for N-methyl-1-[(2R,4R)-4-methylpyrrolidin-2-yl]methanamine is CNC[C@H]1C[C@@H](C)CN1.
What is the InChIKey of N-methyl-1-[(2R,4R)-4-methylpyrrolidin-2-yl]methanamine?
The InChIKey is FEWHVBXCYORMPQ-RNFRBKRXSA-N. The full InChI is InChI=1S/C7H16N2/c1-6-3-7(5-8-2)9-4-6/h6-9H,3-5H2,1-2H3/t6-,7-/m1/s1.
What are the key properties of N-methyl-1-[(2R,4R)-4-methylpyrrolidin-2-yl]methanamine?
N-methyl-1-[(2R,4R)-4-methylpyrrolidin-2-yl]methanamine has a molecular weight of 128.22 g/mol, XLogP of 0.20, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-1-[(2R,4R)-4-methylpyrrolidin-2-yl]methanamine is sourced from PubChem (CID 147487511), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).