(2R)-N-(1-adamantylmethyl)pyrrolidine-2-carboxamide

C16H26N2O — CID 103793910

IUPAC(2R)-N-(1-adamantylmethyl)pyrrolidine-2-carboxamide
SMILESO=C(NCC12CC3CC(CC(C3)C1)C2)[C@H]1CCCN1
InChIInChI=1S/C16H26N2O/c19-15(14-2-1-3-17-14)18-10-16-7-11-4-12(8-16)6-13(5-11)9-16/h11-14,17H,1-10H2,(H,18,19)/t11?,12?,13?,14-,16?/m1/s1
InChIKeyBUXJBMXDYNOMRM-MHCOZEDOSA-N
MW262.40 g/mol
LogP2.07
Rot. Bonds3

About (2R)-N-(1-adamantylmethyl)pyrrolidine-2-carboxamide

(2R)-N-(1-adamantylmethyl)pyrrolidine-2-carboxamide (PubChem CID 103793910) has the molecular formula C16H26N2O and a molecular weight of 262.40 g/mol. Its IUPAC name is (2R)-N-(1-adamantylmethyl)pyrrolidine-2-carboxamide.

Molecular Properties

Compound Name(2R)-N-(1-adamantylmethyl)pyrrolidine-2-carboxamide
PubChem CID103793910
Molecular FormulaC16H26N2O
Molecular Weight262.40 g/mol
Exact Mass262.20
IUPAC Name(2R)-N-(1-adamantylmethyl)pyrrolidine-2-carboxamide
SMILESO=C(NCC12CC3CC(CC(C3)C1)C2)[C@H]1CCCN1
InChIInChI=1S/C16H26N2O/c19-15(14-2-1-3-17-14)18-10-16-7-11-4-12(8-16)6-13(5-11)9-16/h11-14,17H,1-10H2,(H,18,19)/t11?,12?,13?,14-,16?/m1/s1
InChIKeyBUXJBMXDYNOMRM-MHCOZEDOSA-N
XLogP2.07
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.40
LogP ≤ 52.07
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

(2R)-N-(1-adamantylmethyl)-5-oxopyrrolidine-2-carboxamide
CID 42554316
(2S)-N-[(1-methylcyclopentyl)methyl]pyrrolidine-2-carboxamide
CID 63829240
(2S)-N-[(1-ethylcyclopentyl)methyl]pyrrolidine-2-carboxamide
CID 103797869
N-(fluoromethyl)pyrrolidine-2-carboxamide
CID 123273673
N-(1-adamantylmethyl)-N-methylpyrrolidine-2-carboxamide
CID 60711839
(2R)-N-ethylpyrrolidine-2-carboxamide;molecular hydrogen
CID 178045420
N-[[1-(hydroxymethyl)cyclopentyl]methyl]piperidine-2-carboxamide
CID 113293938
(2S)-N-[[1-(hydroxymethyl)cyclopentyl]methyl]piperidine-2-carboxamide
CID 104914457
[[(2S)-pyrrolidine-2-carbonyl]amino]methylboronic acid
CID 74765706
N-(2-amino-2-oxoethyl)pyrrolidine-2-carboxamide
CID 18324145
N-propylpyrrolidine-2-carboxamide
CID 4984185
(2S)-N-[(2,2,3,3-tetramethylcyclopropyl)methyl]pyrrolidine-2-carboxamide
CID 79362349

Frequently Asked Questions

What is the IUPAC name of (2R)-N-(1-adamantylmethyl)pyrrolidine-2-carboxamide?
The IUPAC name of (2R)-N-(1-adamantylmethyl)pyrrolidine-2-carboxamide (CID 103793910) is (2R)-N-(1-adamantylmethyl)pyrrolidine-2-carboxamide.
What is the SMILES notation for (2R)-N-(1-adamantylmethyl)pyrrolidine-2-carboxamide?
The canonical SMILES for (2R)-N-(1-adamantylmethyl)pyrrolidine-2-carboxamide is O=C(NCC12CC3CC(CC(C3)C1)C2)[C@H]1CCCN1.
What is the InChIKey of (2R)-N-(1-adamantylmethyl)pyrrolidine-2-carboxamide?
The InChIKey is BUXJBMXDYNOMRM-MHCOZEDOSA-N. The full InChI is InChI=1S/C16H26N2O/c19-15(14-2-1-3-17-14)18-10-16-7-11-4-12(8-16)6-13(5-11)9-16/h11-14,17H,1-10H2,(H,18,19)/t11?,12?,13?,14-,16?/m1/s1.
What are the key properties of (2R)-N-(1-adamantylmethyl)pyrrolidine-2-carboxamide?
(2R)-N-(1-adamantylmethyl)pyrrolidine-2-carboxamide has a molecular weight of 262.40 g/mol, XLogP of 2.07, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-N-(1-adamantylmethyl)pyrrolidine-2-carboxamide is sourced from PubChem (CID 103793910), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).