(1R)-N-ethyl-1-phenyl-2-pyrrolidin-1-ylethanamine;molecular hydrogen

C14H24N2 — CID 143114287

IUPAC(1R)-N-ethyl-1-phenyl-2-pyrrolidin-1-ylethanamine;molecular hydrogen
SMILESCCN[C@@H](CN1CCCC1)c1ccccc1.[H][H]
InChIInChI=1S/C14H22N2.H2/c1-2-15-14(12-16-10-6-7-11-16)13-8-4-3-5-9-13;/h3-5,8-9,14-15H,2,6-7,10-12H2,1H3;1H/t14-;/m0./s1
InChIKeyNWOZYZBUVOMESR-UQKRIMTDSA-N
MW220.36 g/mol
LogP2.68
Rot. Bonds5

About (1R)-N-ethyl-1-phenyl-2-pyrrolidin-1-ylethanamine;molecular hydrogen

(1R)-N-ethyl-1-phenyl-2-pyrrolidin-1-ylethanamine;molecular hydrogen (PubChem CID 143114287) has the molecular formula C14H24N2 and a molecular weight of 220.36 g/mol. Its IUPAC name is (1R)-N-ethyl-1-phenyl-2-pyrrolidin-1-ylethanamine;molecular hydrogen.

Molecular Properties

Compound Name(1R)-N-ethyl-1-phenyl-2-pyrrolidin-1-ylethanamine;molecular hydrogen
PubChem CID143114287
Molecular FormulaC14H24N2
Molecular Weight220.36 g/mol
Exact Mass220.19
IUPAC Name(1R)-N-ethyl-1-phenyl-2-pyrrolidin-1-ylethanamine;molecular hydrogen
SMILESCCN[C@@H](CN1CCCC1)c1ccccc1.[H][H]
InChIInChI=1S/C14H22N2.H2/c1-2-15-14(12-16-10-6-7-11-16)13-8-4-3-5-9-13;/h3-5,8-9,14-15H,2,6-7,10-12H2,1H3;1H/t14-;/m0./s1
InChIKeyNWOZYZBUVOMESR-UQKRIMTDSA-N
XLogP2.68
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500220.36
LogP ≤ 52.68
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-(4,4-dimethylazepan-1-yl)-N-ethyl-1-phenylethanamine
CID 65280974
N-[(1R)-1-phenyl-2-piperidin-1-ylethyl]propan-1-amine
CID 58330527
N-ethyl-1-phenyl-2-(4-propan-2-ylpiperidin-1-yl)ethanamine
CID 103495170
(1R)-N-(2-ethoxyethyl)-1-phenyl-2-piperidin-1-ylethanamine
CID 89003231
(1S)-N-benzyl-1-phenyl-2-piperidin-1-ylethanamine
CID 11254892
1-(4-tert-butylphenyl)-N-ethyl-2-piperidin-1-ylethanamine
CID 63466191
2-(4-tert-butylpiperidin-1-yl)-N-ethyl-1-phenylethanamine
CID 63468213
N-ethyl-2-(2-methyl-1,4-oxazepan-4-yl)-1-phenylethanamine
CID 62986930
2-(1,3,4,5,7,8,9,9a-octahydropyrrolo[1,2-a][1,4]diazepin-2-yl)-N-ethyl-1-phenylethanamine
CID 63149781
N-[(2-methylphenyl)methyl]-1-phenyl-2-pyrrolidin-1-ylethanamine
CID 78849604
N-(2-morpholin-4-ylethyl)-1-phenyl-2-piperidin-1-ylethanamine
CID 51000971
N-ethyl-1-phenyl-3-(1,4-thiazepan-4-yl)propan-1-amine
CID 62612136

Frequently Asked Questions

What is the IUPAC name of (1R)-N-ethyl-1-phenyl-2-pyrrolidin-1-ylethanamine;molecular hydrogen?
The IUPAC name of (1R)-N-ethyl-1-phenyl-2-pyrrolidin-1-ylethanamine;molecular hydrogen (CID 143114287) is (1R)-N-ethyl-1-phenyl-2-pyrrolidin-1-ylethanamine;molecular hydrogen.
What is the SMILES notation for (1R)-N-ethyl-1-phenyl-2-pyrrolidin-1-ylethanamine;molecular hydrogen?
The canonical SMILES for (1R)-N-ethyl-1-phenyl-2-pyrrolidin-1-ylethanamine;molecular hydrogen is CCN[C@@H](CN1CCCC1)c1ccccc1.[H][H].
What is the InChIKey of (1R)-N-ethyl-1-phenyl-2-pyrrolidin-1-ylethanamine;molecular hydrogen?
The InChIKey is NWOZYZBUVOMESR-UQKRIMTDSA-N. The full InChI is InChI=1S/C14H22N2.H2/c1-2-15-14(12-16-10-6-7-11-16)13-8-4-3-5-9-13;/h3-5,8-9,14-15H,2,6-7,10-12H2,1H3;1H/t14-;/m0./s1.
What are the key properties of (1R)-N-ethyl-1-phenyl-2-pyrrolidin-1-ylethanamine;molecular hydrogen?
(1R)-N-ethyl-1-phenyl-2-pyrrolidin-1-ylethanamine;molecular hydrogen has a molecular weight of 220.36 g/mol, XLogP of 2.68, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (1R)-N-ethyl-1-phenyl-2-pyrrolidin-1-ylethanamine;molecular hydrogen is sourced from PubChem (CID 143114287), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).