tert-butyl N-piperidin-4-ylcarbamate;pyridin-2-amine

C15H26N4O2 — CID 174858928

IUPACtert-butyl N-piperidin-4-ylcarbamate;pyridin-2-amine
SMILESCC(C)(C)OC(=O)NC1CCNCC1.Nc1ccccn1
InChIInChI=1S/C10H20N2O2.C5H6N2/c1-10(2,3)14-9(13)12-8-4-6-11-7-5-8;6-5-3-1-2-4-7-5/h8,11H,4-7H2,1-3H3,(H,12,13);1-4H,(H2,6,7)
InChIKeyNYHFSAWDMXFXGT-UHFFFAOYSA-N
MW294.40 g/mol
LogP1.93
Rot. Bonds1

About tert-butyl N-piperidin-4-ylcarbamate;pyridin-2-amine

tert-butyl N-piperidin-4-ylcarbamate;pyridin-2-amine (PubChem CID 174858928) has the molecular formula C15H26N4O2 and a molecular weight of 294.40 g/mol. Its IUPAC name is tert-butyl N-piperidin-4-ylcarbamate;pyridin-2-amine.

Molecular Properties

Compound Nametert-butyl N-piperidin-4-ylcarbamate;pyridin-2-amine
PubChem CID174858928
Molecular FormulaC15H26N4O2
Molecular Weight294.40 g/mol
Exact Mass294.21
IUPAC Nametert-butyl N-piperidin-4-ylcarbamate;pyridin-2-amine
SMILESCC(C)(C)OC(=O)NC1CCNCC1.Nc1ccccn1
InChIInChI=1S/C10H20N2O2.C5H6N2/c1-10(2,3)14-9(13)12-8-4-6-11-7-5-8;6-5-3-1-2-4-7-5/h8,11H,4-7H2,1-3H3,(H,12,13);1-4H,(H2,6,7)
InChIKeyNYHFSAWDMXFXGT-UHFFFAOYSA-N
XLogP1.93
TPSA89.27 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds1
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500294.40
LogP ≤ 51.93
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

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Related Compounds

tert-butyl N-[4-(pyridine-2-carbonylamino)cyclohexyl]carbamate
CID 86277343
tert-butyl N-piperidin-4-ylcarbamate;formic acid
CID 22990009
tert-butyl N-[4-(2-pyridin-2-ylethylamino)cyclohexyl]carbamate
CID 68885257
tert-butyl N-[2-(piperidin-4-ylamino)phenyl]carbamate
CID 107240213
tert-butyl N-[(3S)-1-(pyridin-2-ylmethyl)piperidin-3-yl]carbamate
CID 97174124
tert-butyl N-[(3R)-1-[(1R)-1-pyridin-2-ylethyl]piperidin-3-yl]carbamate
CID 98232041
tert-butyl N-[(3R)-1-[(1S)-1-pyridin-2-ylethyl]piperidin-3-yl]carbamate
CID 99725150
tert-butyl N-(4-amino-2-pyridin-2-ylbutan-2-yl)carbamate
CID 83693743
tert-butyl N-[(3S)-azepan-3-yl]carbamate;tert-butyl N-[(3R)-azepan-3-yl]carbamate;tert-butyl N-[(4S)-azepan-4-yl]carbamate;tert-butyl N-[(4R)-azepan-4-yl]carbamate;tert-butyl N-[(3S)-piperidin-3-yl]carbamate;tert-butyl N-[(3R)-piperidin-3-yl]carbamate;tert-butyl N-piperidin-4-ylcarbamate;tert-butyl N-[(3S)-pyrrolidin-3-yl]carbamate;tert-butyl N-[(3R)-pyrrolidin-3-yl]carbamate;3-methylazetidine
CID 157216314
tert-butyl N-[(3S)-1-piperidin-4-ylpiperidin-3-yl]carbamate
CID 124909009
tert-butyl N-[(1S,3R)-3-(pyrimidin-2-ylamino)cyclohexyl]carbamate
CID 99620412
tert-butyl N-[3-(2-pyridin-2-ylethylamino)cyclohexyl]carbamate
CID 103719994

Frequently Asked Questions

What is the IUPAC name of tert-butyl N-piperidin-4-ylcarbamate;pyridin-2-amine?
The IUPAC name of tert-butyl N-piperidin-4-ylcarbamate;pyridin-2-amine (CID 174858928) is tert-butyl N-piperidin-4-ylcarbamate;pyridin-2-amine.
What is the SMILES notation for tert-butyl N-piperidin-4-ylcarbamate;pyridin-2-amine?
The canonical SMILES for tert-butyl N-piperidin-4-ylcarbamate;pyridin-2-amine is CC(C)(C)OC(=O)NC1CCNCC1.Nc1ccccn1.
What is the InChIKey of tert-butyl N-piperidin-4-ylcarbamate;pyridin-2-amine?
The InChIKey is NYHFSAWDMXFXGT-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H20N2O2.C5H6N2/c1-10(2,3)14-9(13)12-8-4-6-11-7-5-8;6-5-3-1-2-4-7-5/h8,11H,4-7H2,1-3H3,(H,12,13);1-4H,(H2,6,7).
What are the key properties of tert-butyl N-piperidin-4-ylcarbamate;pyridin-2-amine?
tert-butyl N-piperidin-4-ylcarbamate;pyridin-2-amine has a molecular weight of 294.40 g/mol, XLogP of 1.93, 1 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for tert-butyl N-piperidin-4-ylcarbamate;pyridin-2-amine is sourced from PubChem (CID 174858928), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).