(2S)-1-(2-adamantyl)-2-hydroxypyrrolidine-2-carboxamide

C15H24N2O2 — CID 91597118

IUPAC(2S)-1-(2-adamantyl)-2-hydroxypyrrolidine-2-carboxamide
SMILESNC(=O)[C@@]1(O)CCCN1C1C2CC3CC(C2)CC1C3
InChIInChI=1S/C15H24N2O2/c16-14(18)15(19)2-1-3-17(15)13-11-5-9-4-10(7-11)8-12(13)6-9/h9-13,19H,1-8H2,(H2,16,18)/t9?,10?,11?,12?,13?,15-/m0/s1
InChIKeySBNNQKXQAIBGMM-UCLMFWMVSA-N
MW264.37 g/mol
LogP1.08
Rot. Bonds2

About (2S)-1-(2-adamantyl)-2-hydroxypyrrolidine-2-carboxamide

(2S)-1-(2-adamantyl)-2-hydroxypyrrolidine-2-carboxamide (PubChem CID 91597118) has the molecular formula C15H24N2O2 and a molecular weight of 264.37 g/mol. Its IUPAC name is (2S)-1-(2-adamantyl)-2-hydroxypyrrolidine-2-carboxamide.

Molecular Properties

Compound Name(2S)-1-(2-adamantyl)-2-hydroxypyrrolidine-2-carboxamide
PubChem CID91597118
Molecular FormulaC15H24N2O2
Molecular Weight264.37 g/mol
Exact Mass264.18
IUPAC Name(2S)-1-(2-adamantyl)-2-hydroxypyrrolidine-2-carboxamide
SMILESNC(=O)[C@@]1(O)CCCN1C1C2CC3CC(C2)CC1C3
InChIInChI=1S/C15H24N2O2/c16-14(18)15(19)2-1-3-17(15)13-11-5-9-4-10(7-11)8-12(13)6-9/h9-13,19H,1-8H2,(H2,16,18)/t9?,10?,11?,12?,13?,15-/m0/s1
InChIKeySBNNQKXQAIBGMM-UCLMFWMVSA-N
XLogP1.08
TPSA66.56 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.37
LogP ≤ 51.08
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

1,2-dihydroxypyrrolidine-2-carboxamide
CID 140539676
2-[4-(2-adamantyl)piperazin-1-yl]acetamide
CID 22193964
adamantane;urea
CID 68761520
2-[1-(1-adamantyl)pyrrolidin-2-yl]acetamide
CID 69085045
2-methyl-1-[(3-methylcyclobutyl)methyl]pyrrolidine-2-carboxamide
CID 123486269
1-hydroxycyclopentane-1-carboxamide
CID 12857769
1-(2-adamantyl)pyrrolidine;hydrochloride
CID 12828801
1-(2-adamantyl)azetidine-3-carboxylic acid
CID 71025045
N-[1-(aminomethyl)cyclohexyl]adamantane-2-carboxamide
CID 81099191
2-(1,4-diazepan-1-yl)adamantane-2-carboxamide
CID 62780800
adamantane-1-carboxamide
CID 21686
2-methyladamantane-1-carboxamide
CID 18421545

Frequently Asked Questions

What is the IUPAC name of (2S)-1-(2-adamantyl)-2-hydroxypyrrolidine-2-carboxamide?
The IUPAC name of (2S)-1-(2-adamantyl)-2-hydroxypyrrolidine-2-carboxamide (CID 91597118) is (2S)-1-(2-adamantyl)-2-hydroxypyrrolidine-2-carboxamide.
What is the SMILES notation for (2S)-1-(2-adamantyl)-2-hydroxypyrrolidine-2-carboxamide?
The canonical SMILES for (2S)-1-(2-adamantyl)-2-hydroxypyrrolidine-2-carboxamide is NC(=O)[C@@]1(O)CCCN1C1C2CC3CC(C2)CC1C3.
What is the InChIKey of (2S)-1-(2-adamantyl)-2-hydroxypyrrolidine-2-carboxamide?
The InChIKey is SBNNQKXQAIBGMM-UCLMFWMVSA-N. The full InChI is InChI=1S/C15H24N2O2/c16-14(18)15(19)2-1-3-17(15)13-11-5-9-4-10(7-11)8-12(13)6-9/h9-13,19H,1-8H2,(H2,16,18)/t9?,10?,11?,12?,13?,15-/m0/s1.
What are the key properties of (2S)-1-(2-adamantyl)-2-hydroxypyrrolidine-2-carboxamide?
(2S)-1-(2-adamantyl)-2-hydroxypyrrolidine-2-carboxamide has a molecular weight of 264.37 g/mol, XLogP of 1.08, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2S)-1-(2-adamantyl)-2-hydroxypyrrolidine-2-carboxamide is sourced from PubChem (CID 91597118), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).